Number of particles = 524 A = 1 Angstrom (basic length-scale) H0(1,1) = 23.556 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 66.244 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 4.05429 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 0.128139 0.0101531 1.71149e-18 423 55.845 0.134753 -4.0099 55.845000 Fe 0.0522298 0.0363279 2.18216e-16 424 55.845 0.0576933 -3.88801 55.845000 Fe 0.114553 0.0394294 0.5 425 55.845 0.143742 -3.93769 55.845000 Fe 0.0608466 0.00625111 0.5 427 55.845 0.425467 -3.94248 55.845000 Fe 0.177401 0.0442979 6.28974e-17 457 55.845 0.111093 -3.98389 55.845000 Fe 0.196551 0.0148967 0.5 460 55.845 0.17316 -3.82091 55.845000 Fe 0.259138 0.0193801 1.73289e-16 456 55.845 4.42177 -3.8956 55.845000 Fe 0.24219 0.0474441 0.5 458 55.845 5.42715 -3.86036 55.845000 Fe 0.364867 0.0303779 1 488 55.845 5.48201 -3.38561 55.845000 Fe 0.293143 0.0558063 2.20355e-16 489 55.845 0.836859 -3.52487 55.845000 Fe 0.354826 0.0566077 0.5 490 55.845 4.86528 -3.94089 55.845000 Fe 0.323219 0.0176182 0.5 492 55.845 6.00316 -3.87446 55.845000 Fe 0.490643 0.0345616 7.53058e-17 269 55.845 0.162541 -3.83052 55.845000 Fe 0.478435 0.0636323 0.5 270 55.845 0.0505492 -3.90694 55.845000 Fe 0.430937 0.00393577 4.32152e-16 271 55.845 6.54834 -3.42391 55.845000 Fe 0.49722 0.0030824 0.5 272 55.845 2.26758 -3.73417 55.845000 Fe 0.560847 0.00625111 2.16076e-16 292 55.845 0.425467 -3.94248 55.845000 Fe 0.55223 0.0363279 0.5 294 55.845 0.0576933 -3.88801 55.845000 Fe 0.417408 0.0618959 2.19927e-16 518 55.845 0.144874 -3.82916 55.845000 Fe 0.428169 0.0299696 0.5 520 55.845 3.88306 -3.82813 55.845000 Fe 0.614553 0.0394294 1.75428e-16 288 55.845 0.143742 -3.93769 55.845000 Fe 0.628139 0.0101531 0.5 293 55.845 0.134753 -4.0099 55.845000 Fe 0.74219 0.0474441 3.30746e-16 321 55.845 5.42715 -3.86036 55.845000 Fe 0.696551 0.0148967 1.16809e-16 325 55.845 0.17316 -3.82091 55.845000 Fe 0.759138 0.0193801 0.5 326 55.845 4.42177 -3.8956 55.845000 Fe 0.677401 0.0442979 0.5 327 55.845 0.111093 -3.98389 55.845000 Fe 0.793143 0.0558063 0.5 359 55.845 0.836859 -3.52487 55.845000 Fe 0.99722 0.0030824 4.33008e-16 389 55.845 2.26758 -3.73417 55.845000 Fe 0.854826 0.0566077 6.45661e-16 353 55.845 4.86528 -3.94089 55.845000 Fe 0.823219 0.0176182 5.0703e-16 357 55.845 6.00316 -3.87446 55.845000 Fe 0.864867 0.0303779 0.5 358 55.845 5.48201 -3.38561 55.845000 Fe 0.978435 0.0636323 2.17788e-16 385 55.845 0.0505492 -3.90694 55.845000 Fe 0.928169 0.0299696 1.6088e-16 390 55.845 3.88306 -3.82813 55.845000 Fe 0.990643 0.0345616 0.5 391 55.845 0.162541 -3.83052 55.845000 Fe 0.917408 0.0618959 0.5 392 55.845 0.144874 -3.82916 55.845000 Fe 0.930937 0.00393577 0.5 393 55.845 6.54834 -3.42391 55.845000 Fe 0.0688149 0.132412 5.04463e-16 415 55.845 0.00673324 -3.84293 55.845000 Fe 0.100088 0.0706391 3.55991e-16 419 55.845 0.0250009 -3.8914 55.845000 Fe 0.0248892 0.0977554 5.16871e-16 420 55.845 0.00930463 -3.88904 55.845000 Fe 0.0854486 0.101304 0.5 421 55.845 0.0263565 -3.87245 55.845000 Fe 0.00980956 0.128563 0.5 422 55.845 0.00645497 -3.86628 55.845000 Fe 0.0400171 0.0674798 0.5 426 55.845 0.0212115 -3.86309 55.845000 Fe 0.14294 0.10591 3.65404e-16 453 55.845 0.0446211 -3.7925 55.845000 Fe 0.161319 0.073574 0.5 459 55.845 0.192667 -3.92043 55.845000 Fe 0.217347 0.0801621 6.46089e-17 452 55.845 0.212006 -3.74756 55.845000 Fe 0.203631 0.109181 0.5 454 55.845 0.0449171 -3.90823 55.845000 Fe 0.342002 0.0882182 2.21639e-16 484 55.845 0.0681848 -3.82862 55.845000 Fe 0.265089 0.113747 2.89243e-16 485 55.845 0.0170171 -3.88462 55.845000 Fe 0.327241 0.117107 0.5 486 55.845 0.0121218 -3.91164 55.845000 Fe 0.279931 0.0834055 0.5 491 55.845 0.100801 -3.92243 55.845000 Fe 0.388553 0.121441 3.71394e-16 516 55.845 0.017451 -3.85186 55.845000 Fe 0.464717 0.0948599 5.56236e-17 267 55.845 0.0299011 -3.85472 55.845000 Fe 0.449148 0.124556 0.5 268 55.845 0.00878269 -3.89817 55.845000 Fe 0.585449 0.101304 4.37287e-16 284 55.845 0.0263565 -3.87245 55.845000 Fe 0.50981 0.128563 7.57336e-17 285 55.845 0.00645497 -3.86628 55.845000 Fe 0.568815 0.132412 0.5 286 55.845 0.00673324 -3.84293 55.845000 Fe 0.540017 0.0674798 5.00612e-17 289 55.845 0.0212115 -3.86309 55.845000 Fe 0.524889 0.0977554 0.5 291 55.845 0.00930463 -3.88904 55.845000 Fe 0.403202 0.0904717 0.5 519 55.845 0.044067 -3.92542 55.845000 Fe 0.600088 0.0706391 0.5 290 55.845 0.0250009 -3.8914 55.845000 Fe 0.703631 0.109181 8.5917e-16 317 55.845 0.0449171 -3.90823 55.845000 Fe 0.661319 0.073574 6.08864e-16 322 55.845 0.192667 -3.92043 55.845000 Fe 0.717347 0.0801621 0.5 323 55.845 0.212006 -3.74756 55.845000 Fe 0.64294 0.10591 0.5 324 55.845 0.0446211 -3.7925 55.845000 Fe 0.779931 0.0834055 4.52262e-16 354 55.845 0.100801 -3.92243 55.845000 Fe 0.765089 0.113747 0.5 356 55.845 0.0170171 -3.88462 55.845000 Fe 0.827241 0.117107 3.04218e-16 349 55.845 0.0121218 -3.91164 55.845000 Fe 0.842002 0.0882182 0.5 355 55.845 0.0681848 -3.82862 55.845000 Fe 0.949148 0.124556 2.87103e-16 381 55.845 0.00878269 -3.89817 55.845000 Fe 0.903202 0.0904717 4.18888e-16 386 55.845 0.044067 -3.92542 55.845000 Fe 0.964717 0.0948599 0.5 387 55.845 0.0299011 -3.85472 55.845000 Fe 0.888553 0.121441 0.5 388 55.845 0.017451 -3.85186 55.845000 Fe 0.039279 0.192939 0 411 55.845 0.000115818 -3.88146 55.845000 Fe 0.0542471 0.162757 0.5 417 55.845 0.00238226 -3.87414 55.845000 Fe 0.189615 0.139922 5.97739e-16 448 55.845 0.00420228 -3.87162 55.845000 Fe 0.114747 0.166502 6.60637e-16 449 55.845 0.000843483 -3.87725 55.845000 Fe 0.175513 0.170018 0.5 450 55.845 0.0016529 -3.88634 55.845000 Fe 0.100138 0.196667 0.5 451 55.845 0.00104443 -3.87998 55.845000 Fe 0.129154 0.136012 0.5 455 55.845 0.0070632 -3.88125 55.845000 Fe 0.311751 0.147475 2.50306e-16 480 55.845 0.00517244 -3.88028 55.845000 Fe 0.235988 0.173898 2.45172e-16 481 55.845 0.00176671 -3.87588 55.845000 Fe 0.296636 0.177453 0.5 482 55.845 0.00297995 -3.89074 55.845000 Fe 0.250729 0.143272 0.5 487 55.845 0.0096309 -3.90648 55.845000 Fe 0.357275 0.181475 6.37532e-17 513 55.845 0.00102634 -3.87997 55.845000 Fe 0.372917 0.151109 0.5 517 55.845 0.00251092 -3.89469 55.845000 Fe 0.554247 0.162757 5.30135e-16 280 55.845 0.00238226 -3.87414 55.845000 Fe 0.47858 0.189193 2.83252e-16 281 55.845 0.000737171 -3.87166 55.845000 Fe 0.539279 0.192939 0.5 282 55.845 0.000115818 -3.88146 55.845000 Fe 0.493672 0.158896 0.5 287 55.845 0.00190645 -3.87062 55.845000 Fe 0.43369 0.155187 5.18583e-16 512 55.845 0.00276064 -3.86436 55.845000 Fe 0.417875 0.185285 0.5 514 55.845 0.000445548 -3.87917 55.845000 Fe 0.675513 0.170018 8.55747e-19 313 55.845 0.0016529 -3.88634 55.845000 Fe 0.600138 0.196667 4.27874e-19 314 55.845 0.00104443 -3.87998 55.845000 Fe 0.629154 0.136012 3.13203e-16 318 55.845 0.0070632 -3.88125 55.845000 Fe 0.689615 0.139922 0.5 319 55.845 0.00420228 -3.87162 55.845000 Fe 0.614747 0.166502 0.5 320 55.845 0.000843483 -3.87725 55.845000 Fe 0.796636 0.177453 2.07947e-16 345 55.845 0.00297995 -3.89074 55.845000 Fe 0.750729 0.143272 5.88754e-16 350 55.845 0.0096309 -3.90648 55.845000 Fe 0.735988 0.173898 0.5 352 55.845 0.00176671 -3.87588 55.845000 Fe 0.811751 0.147475 0.5 351 55.845 0.00517244 -3.88028 55.845000 Fe 0.917875 0.185285 2.63998e-16 377 55.845 0.000445548 -3.87917 55.845000 Fe 0.872917 0.151109 2.17788e-16 382 55.845 0.00251092 -3.89469 55.845000 Fe 0.93369 0.155187 0.5 383 55.845 0.00276064 -3.86436 55.845000 Fe 0.857275 0.181475 0.5 384 55.845 0.00102634 -3.87997 55.845000 Fe 0.993672 0.158896 4.24451e-16 416 55.845 0.00190645 -3.87062 55.845000 Fe 0.97858 0.189193 0.5 418 55.845 0.000737171 -3.87166 55.845000 Fe 0.00904272 0.253355 0 407 55.845 0.00170175 -3.87218 55.845000 Fe 0.0242603 0.223051 0.5 413 55.845 0.000727554 -3.87224 55.845000 Fe 0.129803 0.261091 8.55747e-19 440 55.845 0.002298 -3.89282 55.845000 Fe 0.160672 0.200547 1.34352e-16 444 55.845 0.00126049 -3.87931 55.845000 Fe 0.084861 0.226951 0 445 55.845 0.00043036 -3.87729 55.845000 Fe 0.145462 0.230729 0.5 446 55.845 0.000975938 -3.87972 55.845000 Fe 0.0691067 0.257056 0.5 447 55.845 0.00201823 -3.86432 55.845000 Fe 0.190956 0.264722 0.5 479 55.845 0.00420461 -3.88239 55.845000 Fe 0.281555 0.208037 2.1522e-16 476 55.845 0.000688694 -3.87997 55.845000 Fe 0.206112 0.234732 0 477 55.845 0.00263812 -3.88988 55.845000 Fe 0.266775 0.238306 0.5 478 55.845 0.0015314 -3.87759 55.845000 Fe 0.221178 0.204156 0.5 483 55.845 0.000782527 -3.88102 55.845000 Fe 0.32727 0.242173 2.78118e-17 509 55.845 0.00110173 -3.88532 55.845000 Fe 0.388027 0.245739 0.5 510 55.845 0.000623282 -3.87847 55.845000 Fe 0.342059 0.21167 0.5 515 55.845 0.00124065 -3.88086 55.845000 Fe 0.52426 0.223051 1.31785e-16 277 55.845 0.000727554 -3.87224 55.845000 Fe 0.448498 0.249477 2.47311e-16 278 55.845 0.00215548 -3.87371 55.845000 Fe 0.509043 0.253355 0.5 279 55.845 0.00170175 -3.87218 55.845000 Fe 0.463489 0.219302 0.5 283 55.845 9.42566e-05 -3.88218 55.845000 Fe 0.569107 0.257056 1 310 55.845 0.00201823 -3.86432 55.845000 Fe 0.584861 0.226951 0.5 316 55.845 0.00043036 -3.87729 55.845000 Fe 0.402663 0.21555 2.13937e-16 508 55.845 0.000866502 -3.88031 55.845000 Fe 0.645462 0.230729 6.67483e-17 309 55.845 0.000975938 -3.87972 55.845000 Fe 0.629803 0.261091 0.5 311 55.845 0.002298 -3.89282 55.845000 Fe 0.660672 0.200547 0.5 315 55.845 0.00126049 -3.87931 55.845000 Fe 0.766775 0.238306 0 341 55.845 0.0015314 -3.87759 55.845000 Fe 0.690956 0.264722 0 342 55.845 0.00420461 -3.88239 55.845000 Fe 0.721178 0.204156 1 346 55.845 0.000782527 -3.88102 55.845000 Fe 0.781555 0.208037 0.5 347 55.845 0.000688694 -3.87997 55.845000 Fe 0.706112 0.234732 0.5 348 55.845 0.00263812 -3.88988 55.845000 Fe 0.888027 0.245739 1.18093e-16 373 55.845 0.000623282 -3.87847 55.845000 Fe 0.842059 0.21167 2.14365e-16 378 55.845 0.00124065 -3.88086 55.845000 Fe 0.902663 0.21555 0.5 379 55.845 0.000866502 -3.88031 55.845000 Fe 0.82727 0.242173 0.5 380 55.845 0.00110173 -3.88532 55.845000 Fe 0.963489 0.219302 0 412 55.845 9.42566e-05 -3.88218 55.845000 Fe 0.948498 0.249477 0.5 414 55.845 0.00215548 -3.87371 55.845000 Fe 0.0994412 0.321734 2.20355e-16 436 55.845 0.0380125 -3.92654 55.845000 Fe 0.0535464 0.287666 1 441 55.845 0.00845941 -3.89794 55.845000 Fe 0.114204 0.290825 0.5 442 55.845 0.0137022 -3.85466 55.845000 Fe 0.0380223 0.317384 0.5 443 55.845 0.0284016 -3.85274 55.845000 Fe 0.175476 0.295059 9.37043e-17 473 55.845 0.00857218 -3.90935 55.845000 Fe 0.16059 0.324084 0.5 475 55.845 0.0564493 -3.82903 55.845000 Fe 0.222291 0.328807 2.33619e-16 468 55.845 0.0750268 -3.91928 55.845000 Fe 0.252007 0.268881 7.05991e-17 472 55.845 0.00716019 -3.90343 55.845000 Fe 0.237474 0.298477 0.5 474 55.845 0.0130296 -3.88297 55.845000 Fe 0.373485 0.276201 2.67421e-16 504 55.845 0.00478817 -3.87931 55.845000 Fe 0.298743 0.30296 2.94805e-16 505 55.845 0.0314382 -3.90437 55.845000 Fe 0.359446 0.30639 0.5 506 55.845 0.0301231 -3.80991 55.845000 Fe 0.313098 0.272315 0.5 511 55.845 0.00338082 -3.87349 55.845000 Fe 0.284632 0.332152 0.5 507 55.845 0.151317 -3.76923 55.845000 Fe 0.433848 0.279866 0.5 6 55.845 0.00510261 -3.85146 55.845000 Fe 0.417395 0.310787 2.78974e-16 123 55.845 0.0149012 -3.87119 55.845000 Fe 0.492971 0.283641 0 275 55.845 0.00541088 -3.8625 55.845000 Fe 0.477896 0.314517 0.5 276 55.845 0.0105928 -3.89143 55.845000 Fe 0.538022 0.317384 1 306 55.845 0.0284016 -3.85274 55.845000 Fe 0.553546 0.287666 0.5 312 55.845 0.00845941 -3.89794 55.845000 Fe 0.599441 0.321734 0.5 307 55.845 0.0380125 -3.92654 55.845000 Fe 0.614204 0.290825 2.3533e-16 305 55.845 0.0137022 -3.85466 55.845000 Fe 0.737474 0.298477 1.19805e-17 337 55.845 0.0130296 -3.88297 55.845000 Fe 0.66059 0.324084 2.52445e-16 338 55.845 0.0564493 -3.82903 55.845000 Fe 0.722291 0.328807 0.5 339 55.845 0.0750268 -3.91928 55.845000 Fe 0.752007 0.268881 0.5 343 55.845 0.00716019 -3.90343 55.845000 Fe 0.675476 0.295059 0.5 344 55.845 0.00857218 -3.90935 55.845000 Fe 0.798743 0.30296 0.5 376 55.845 0.0314382 -3.90437 55.845000 Fe 0.784632 0.332152 2.45172e-16 370 55.845 0.151317 -3.76923 55.845000 Fe 0.859446 0.30639 1.51467e-16 369 55.845 0.0301231 -3.80991 55.845000 Fe 0.813098 0.272315 4.03485e-16 374 55.845 0.00338082 -3.87349 55.845000 Fe 0.873485 0.276201 0.5 375 55.845 0.00478817 -3.87931 55.845000 Fe 0.977896 0.314517 1.0055e-16 403 55.845 0.0105928 -3.89143 55.845000 Fe 0.933848 0.279866 2.31052e-17 408 55.845 0.00510261 -3.85146 55.845000 Fe 0.992971 0.283641 0.5 409 55.845 0.00541088 -3.8625 55.845000 Fe 0.917395 0.310787 0.5 410 55.845 0.0149012 -3.87119 55.845000 Fe 0.0737697 0.382583 4.36431e-16 432 55.845 4.29336 -3.8562 55.845000 Fe 0.0242121 0.348705 2.21211e-16 437 55.845 0.0548863 -3.91563 55.845000 Fe 0.0851085 0.350409 0.5 438 55.845 0.134591 -3.82769 55.845000 Fe 0.0113576 0.377638 0.5 439 55.845 0.156814 -3.83563 55.845000 Fe 0.18036 0.393881 2.22066e-16 464 55.845 5.78445 -3.85974 55.845000 Fe 0.147227 0.355674 2.20783e-16 469 55.845 0.358117 -3.94495 55.845000 Fe 0.136442 0.382233 0.5 471 55.845 5.40339 -3.41815 55.845000 Fe 0.387385 0.372407 2.18216e-16 152 55.845 0.101597 -3.93224 55.845000 Fe 0.208637 0.356709 0.5 470 55.845 0.638785 -3.5657 55.845000 Fe 0.305663 0.397179 5.33558e-16 496 55.845 0.148382 -3.83252 55.845000 Fe 0.341355 0.338269 4.07764e-16 500 55.845 0.125302 -3.91378 55.845000 Fe 0.260922 0.36441 5.80624e-16 501 55.845 0.426209 -3.86573 55.845000 Fe 0.324995 0.367744 0.5 502 55.845 0.0777736 -3.96422 55.845000 Fe 0.243648 0.392705 0.5 503 55.845 4.60362 -3.88069 55.845000 Fe 0.402485 0.341507 0.5 7 55.845 0.0187308 -3.89185 55.845000 Fe 0.462635 0.344671 2.12653e-16 273 55.845 0.0202363 -3.86454 55.845000 Fe 0.449749 0.375823 0.5 274 55.845 0.0560491 -3.89663 55.845000 Fe 0.585108 0.350409 5.56236e-18 301 55.845 0.134591 -3.82769 55.845000 Fe 0.511358 0.377638 2.19499e-16 302 55.845 0.156814 -3.83563 55.845000 Fe 0.57377 0.382583 0.5 303 55.845 4.29336 -3.8562 55.845000 Fe 0.524212 0.348705 0.5 308 55.845 0.0548863 -3.91563 55.845000 Fe 0.708637 0.356709 3.85086e-18 333 55.845 0.638785 -3.5657 55.845000 Fe 0.636442 0.382233 2.19071e-16 334 55.845 5.40339 -3.41815 55.845000 Fe 0.68036 0.393881 0.5 335 55.845 5.78445 -3.85974 55.845000 Fe 0.647227 0.355674 0.5 340 55.845 0.358117 -3.94495 55.845000 Fe 0.743648 0.392705 4.09903e-16 366 55.845 4.60362 -3.88069 55.845000 Fe 0.760922 0.36441 0.5 372 55.845 0.426209 -3.86573 55.845000 Fe 0.824995 0.367744 3.0593e-16 365 55.845 0.0777736 -3.96422 55.845000 Fe 0.805663 0.397179 0.5 367 55.845 0.148382 -3.83252 55.845000 Fe 0.841355 0.338269 0.5 371 55.845 0.125302 -3.91378 55.845000 Fe 0.949749 0.375823 2.21639e-16 399 55.845 0.0560491 -3.89663 55.845000 Fe 0.902485 0.341507 4.9505e-16 404 55.845 0.0187308 -3.89185 55.845000 Fe 0.962635 0.344671 0.5 405 55.845 0.0202363 -3.86454 55.845000 Fe 0.887385 0.372407 0.5 406 55.845 0.101597 -3.93224 55.845000 Fe 0.0292422 0.455537 3.76101e-16 428 55.845 8.4725 -3.93425 55.845000 Fe 0.0692947 0.408559 0.5 434 55.845 6.28584 -3.41222 55.845000 Fe 0.165249 0.455853 2.19927e-16 461 55.845 0.0236915 -3.66334 55.845000 Fe 0.103086 0.425837 4.35147e-16 465 55.845 6.59154 -3.97589 55.845000 Fe 0.169393 0.42228 0.5 466 55.845 3.37101 -4.01248 55.845000 Fe 0.10236 0.455423 0.5 467 55.845 2.63503 -4.13021 55.845000 Fe 0.00329733 0.40927 1.86553e-16 433 55.845 2.62556 -3.7624 55.845000 Fe 0.00560198 0.435742 0.5 435 55.845 4.62269 -3.64865 55.845000 Fe 0.373188 0.401848 0.5 127 55.845 0.108223 -3.99844 55.845000 Fe 0.347496 0.456313 0.5 189 55.845 1.66796 -3.71507 55.845000 Fe 0.357224 0.428399 4.35147e-16 266 55.845 0.470185 -3.77776 55.845000 Fe 0.287147 0.456003 2.19071e-16 493 55.845 0.239995 -3.67169 55.845000 Fe 0.230527 0.425457 4.3472e-16 497 55.845 0.180183 -3.70873 55.845000 Fe 0.291126 0.425643 0.5 498 55.845 0.469732 -3.80134 55.845000 Fe 0.224411 0.455862 0.5 499 55.845 0.204527 -3.88415 55.845000 Fe 0.430945 0.434447 0.5 264 55.845 9.50962 -3.89683 55.845000 Fe 0.569295 0.408559 4.70661e-18 297 55.845 6.28584 -3.41222 55.845000 Fe 0.505602 0.435742 2.21639e-16 298 55.845 4.62269 -3.64865 55.845000 Fe 0.529242 0.455537 0.5 299 55.845 8.4725 -3.93425 55.845000 Fe 0.503297 0.40927 0.5 304 55.845 2.62556 -3.7624 55.845000 Fe 0.420566 0.456314 4.70661e-18 521 55.845 1.57925 -3.41574 55.845000 Fe 0.439706 0.405575 3.42299e-18 524 55.845 0.331043 -3.9345 55.845000 Fe 0.669393 0.42228 4.70661e-18 329 55.845 3.37101 -4.01248 55.845000 Fe 0.60236 0.455423 2.45172e-16 330 55.845 2.63503 -4.13021 55.845000 Fe 0.665249 0.455853 0.5 331 55.845 0.0236915 -3.66334 55.845000 Fe 0.603086 0.425837 0.5 336 55.845 6.59154 -3.97589 55.845000 Fe 0.791126 0.425643 1 361 55.845 0.469732 -3.80134 55.845000 Fe 0.724411 0.455862 2.19499e-16 362 55.845 0.204527 -3.88415 55.845000 Fe 0.787147 0.456003 0.5 363 55.845 0.239995 -3.67169 55.845000 Fe 0.730527 0.425457 0.5 368 55.845 0.180183 -3.70873 55.845000 Fe 0.930945 0.434447 3.07641e-16 395 55.845 9.50962 -3.89683 55.845000 Fe 0.847496 0.456313 2.02384e-16 396 55.845 1.66796 -3.71507 55.845000 Fe 0.920566 0.456314 0.5 397 55.845 1.57925 -3.41574 55.845000 Fe 0.873188 0.401848 2.06235e-16 400 55.845 0.108223 -3.99844 55.845000 Fe 0.939706 0.405575 0.5 401 55.845 0.331043 -3.9345 55.845000 Fe 0.857224 0.428399 0.5 402 55.845 0.470185 -3.77776 55.845000 Fe 0.176957 0.517484 1.15526e-17 58 55.845 6.0281 -3.87511 55.845000 Fe 0.135457 0.530305 0.5 59 55.845 5.49445 -3.38187 55.845000 Fe 0.0721554 0.529877 2.92666e-16 91 55.845 3.86092 -3.82617 55.845000 Fe 0.0694502 0.503875 0.5 93 55.845 6.58044 -3.42293 55.845000 Fe 0.00763859 0.476102 0.5 430 55.845 4.42479 -3.70472 55.845000 Fe 0.10092 0.485414 2.90954e-17 462 55.845 6.99469 -3.99229 55.845000 Fe 0.167794 0.489141 0.5 463 55.845 2.96576 -4.02009 55.845000 Fe 0.0031787 0.502974 5.80624e-16 89 55.845 2.25091 -3.73009 55.845000 Fe 0.303612 0.514825 2.19071e-16 26 55.845 0.18224 -3.82043 55.845000 Fe 0.240984 0.519318 0.5 27 55.845 4.41626 -3.89314 55.845000 Fe 0.229348 0.486367 2.09658e-17 494 55.845 0.174101 -3.69005 55.845000 Fe 0.289479 0.486561 0.5 495 55.845 0.601185 -3.78387 55.845000 Fe 0.356111 0.483857 2.19927e-16 522 55.845 10.5353 -3.76034 55.845000 Fe 0.372199 0.510022 0.5 523 55.845 0.140507 -4.01131 55.845000 Fe 0.503179 0.502974 0.5 2 55.845 2.25091 -3.73009 55.845000 Fe 0.56945 0.503875 2.99512e-18 222 55.845 6.58044 -3.42293 55.845000 Fe 0.572155 0.529877 0.5 224 55.845 3.86092 -3.82617 55.845000 Fe 0.507639 0.476102 2.19927e-16 295 55.845 4.42479 -3.70472 55.845000 Fe 0.439583 0.506097 2.978e-16 296 55.845 0.442102 -3.94473 55.845000 Fe 0.431959 0.477647 0.5 300 55.845 10.5914 -3.8781 55.845000 Fe 0.60092 0.485414 0.5 332 55.845 6.99469 -3.99229 55.845000 Fe 0.740984 0.519318 3.52568e-16 157 55.845 4.41626 -3.89314 55.845000 Fe 0.635457 0.530305 3.89365e-16 190 55.845 5.49445 -3.38187 55.845000 Fe 0.676957 0.517484 0.5 194 55.845 6.0281 -3.87511 55.845000 Fe 0.667794 0.489141 2.80257e-16 328 55.845 2.96576 -4.02009 55.845000 Fe 0.789479 0.486561 2.35758e-16 360 55.845 0.601185 -3.78387 55.845000 Fe 0.729348 0.486367 0.5 364 55.845 0.174101 -3.69005 55.845000 Fe 0.803612 0.514825 0.5 161 55.845 0.18224 -3.82043 55.845000 Fe 0.872199 0.510022 4.20172e-16 394 55.845 0.140507 -4.01131 55.845000 Fe 0.856111 0.483857 0.5 398 55.845 10.5353 -3.76034 55.845000 Fe 0.931959 0.477647 3.83803e-16 429 55.845 10.5914 -3.8781 55.845000 Fe 0.939583 0.506097 0.5 431 55.845 0.442102 -3.94473 55.845000 Fe 0.145507 0.556505 1.92115e-16 57 55.845 4.84839 -3.9399 55.845000 Fe 0.158258 0.588144 0.5 62 55.845 0.0716817 -3.82625 55.845000 Fe 0.0218436 0.563521 1.76712e-16 90 55.845 0.0512329 -3.90675 55.845000 Fe 0.00969017 0.534459 0.5 92 55.845 0.163579 -3.82945 55.845000 Fe 0.0970734 0.590357 4.55257e-16 95 55.845 0.0462385 -3.9261 55.845000 Fe 0.0355001 0.594755 0.5 96 55.845 0.0313346 -3.85489 55.845000 Fe 0.0828873 0.561815 0.5 97 55.845 0.147914 -3.83004 55.845000 Fe 0.385753 0.53928 4.3258e-16 5 55.845 0.150063 -3.93868 55.845000 Fe 0.258039 0.547351 2.18216e-16 25 55.845 5.42232 -3.85953 55.845000 Fe 0.338999 0.573446 2.23778e-16 29 55.845 0.195296 -3.92056 55.845000 Fe 0.282995 0.580047 0.5 30 55.845 0.215162 -3.74738 55.845000 Fe 0.322874 0.544146 0.5 31 55.845 0.113955 -3.98561 55.845000 Fe 0.22035 0.583309 4.35575e-16 61 55.845 0.101963 -3.92301 55.845000 Fe 0.207114 0.555748 0.5 63 55.845 0.850651 -3.52115 55.845000 Fe 0.40019 0.57052 0.5 10 55.845 0.0253855 -3.89165 55.845000 Fe 0.50969 0.534459 3.31602e-16 1 55.845 0.163579 -3.82945 55.845000 Fe 0.5355 0.594755 6.49084e-16 3 55.845 0.0313346 -3.85489 55.845000 Fe 0.521844 0.563521 0.5 4 55.845 0.0512329 -3.90675 55.845000 Fe 0.460254 0.567345 2.0324e-16 9 55.845 0.0216931 -3.86308 55.845000 Fe 0.44809 0.536204 0.5 11 55.845 0.0582007 -3.88838 55.845000 Fe 0.475386 0.59765 0.5 15 55.845 0.00970028 -3.88786 55.845000 Fe 0.582887 0.561815 1 223 55.845 0.147914 -3.83004 55.845000 Fe 0.597073 0.590357 0.5 228 55.845 0.0462385 -3.9261 55.845000 Fe 0.782995 0.580047 1.94682e-16 158 55.845 0.215162 -3.74738 55.845000 Fe 0.758039 0.547351 0.5 160 55.845 5.42232 -3.85953 55.845000 Fe 0.658258 0.588144 2.21211e-16 191 55.845 0.0716817 -3.82625 55.845000 Fe 0.707114 0.555748 4.57825e-17 192 55.845 0.850651 -3.52115 55.845000 Fe 0.645507 0.556505 0.5 193 55.845 4.84839 -3.9399 55.845000 Fe 0.72035 0.583309 0.5 198 55.845 0.101963 -3.92301 55.845000 Fe 0.90019 0.57052 5.32275e-16 124 55.845 0.0253855 -3.89165 55.845000 Fe 0.94809 0.536204 5.51101e-16 125 55.845 0.0582007 -3.88838 55.845000 Fe 0.885753 0.53928 0.5 126 55.845 0.150063 -3.93868 55.845000 Fe 0.975386 0.59765 4.35147e-16 129 55.845 0.00970028 -3.88786 55.845000 Fe 0.960254 0.567345 0.5 131 55.845 0.0216931 -3.86308 55.845000 Fe 0.822874 0.544146 1.03973e-16 159 55.845 0.113955 -3.98561 55.845000 Fe 0.838999 0.573446 0.5 165 55.845 0.195296 -3.92056 55.845000 Fe 0.17302 0.617015 5.30135e-16 60 55.845 0.0123139 -3.91224 55.845000 Fe 0.188594 0.647381 0.5 66 55.845 0.0053245 -3.88082 55.845000 Fe 0.0511469 0.62445 4.33008e-16 94 55.845 0.00916003 -3.8991 55.845000 Fe 0.127419 0.651027 2.64854e-16 99 55.845 0.00230595 -3.89527 55.845000 Fe 0.0666272 0.655097 0.5 100 55.845 0.00276144 -3.86477 55.845000 Fe 0.11172 0.621349 0.5 101 55.845 0.0180055 -3.85077 55.845000 Fe 0.00665889 0.65881 1.0055e-16 133 55.845 0.00199306 -3.87044 55.845000 Fe 0.296712 0.609068 6.67483e-16 28 55.845 0.045767 -3.90781 55.845000 Fe 0.371189 0.635905 2.18216e-16 33 55.845 0.00731053 -3.88091 55.845000 Fe 0.310733 0.639826 0.5 34 55.845 0.00444894 -3.8726 55.845000 Fe 0.357376 0.605802 0.5 35 55.845 0.0444541 -3.79204 55.845000 Fe 0.385604 0.666419 0.5 39 55.845 0.000928915 -3.87729 55.845000 Fe 0.249573 0.643167 3.42299e-18 65 55.845 0.0102087 -3.90666 55.845000 Fe 0.235257 0.613631 0.5 67 55.845 0.0171497 -3.88611 55.845000 Fe 0.414863 0.601202 5.43827e-16 8 55.845 0.0257179 -3.87199 55.845000 Fe 0.446084 0.662674 2.16076e-16 12 55.845 0.00261619 -3.87424 55.845000 Fe 0.490471 0.628465 6.34537e-16 13 55.845 0.00681946 -3.86489 55.845000 Fe 0.431538 0.632321 0.5 14 55.845 0.00724208 -3.84216 55.845000 Fe 0.506659 0.65881 0.5 19 55.845 0.00199306 -3.87044 55.845000 Fe 0.566627 0.655097 4.22739e-16 225 55.845 0.00276144 -3.86477 55.845000 Fe 0.551147 0.62445 0.5 227 55.845 0.00916003 -3.8991 55.845000 Fe 0.796712 0.609068 0.5 164 55.845 0.045767 -3.90781 55.845000 Fe 0.688594 0.647381 1.78423e-16 195 55.845 0.0053245 -3.88082 55.845000 Fe 0.735257 0.613631 3.14915e-16 196 55.845 0.0171497 -3.88611 55.845000 Fe 0.67302 0.617015 0.5 197 55.845 0.0123139 -3.91224 55.845000 Fe 0.749573 0.643167 0.5 202 55.845 0.0102087 -3.90666 55.845000 Fe 0.61172 0.621349 5.95172e-16 226 55.845 0.0180055 -3.85077 55.845000 Fe 0.627419 0.651027 0.5 232 55.845 0.00230595 -3.89527 55.845000 Fe 0.931538 0.632321 4.35575e-16 128 55.845 0.00724208 -3.84216 55.845000 Fe 0.914863 0.601202 0.5 130 55.845 0.0257179 -3.87199 55.845000 Fe 0.946084 0.662674 0.5 134 55.845 0.00261619 -3.87424 55.845000 Fe 0.990471 0.628465 0.5 135 55.845 0.00681946 -3.86489 55.845000 Fe 0.810733 0.639826 2.20355e-16 162 55.845 0.00444894 -3.8726 55.845000 Fe 0.857376 0.605802 2.20355e-16 163 55.845 0.0444541 -3.79204 55.845000 Fe 0.885604 0.666419 2.18643e-16 167 55.845 0.000928915 -3.87729 55.845000 Fe 0.871189 0.635905 0.5 169 55.845 0.00731053 -3.88091 55.845000 Fe 0.082436 0.68521 7.17544e-16 98 55.845 0.000434604 -3.87924 55.845000 Fe 0.158286 0.711602 1.77568e-16 103 55.845 0.00115232 -3.88098 55.845000 Fe 0.0977178 0.715468 0.5 104 55.845 0.000970707 -3.87997 55.845000 Fe 0.143087 0.681401 0.5 105 55.845 0.000994439 -3.88024 55.845000 Fe 0.0368039 0.719238 2.0923e-16 137 55.845 9.85073e-05 -3.88293 55.845000 Fe 0.0217652 0.68912 0.5 139 55.845 0.000832993 -3.87176 55.845000 Fe 0.324807 0.669914 4.33008e-16 32 55.845 0.00206391 -3.88659 55.845000 Fe 0.354886 0.730679 3.28607e-16 36 55.845 0.00106802 -3.87904 55.845000 Fe 0.339671 0.700479 0.5 38 55.845 0.00138925 -3.87864 55.845000 Fe 0.203715 0.677382 4.3258e-16 64 55.845 0.00278099 -3.89061 55.845000 Fe 0.279199 0.704081 5.60514e-17 69 55.845 0.000795188 -3.88054 55.845000 Fe 0.218835 0.707968 0.5 70 55.845 0.000774655 -3.88061 55.845000 Fe 0.264365 0.673815 0.5 71 55.845 0.00188862 -3.87534 55.845000 Fe 0.400167 0.696588 0 37 55.845 0.00125565 -3.88033 55.845000 Fe 0.476042 0.722987 2.15648e-16 16 55.845 0.000841302 -3.87207 55.845000 Fe 0.521765 0.68912 2.16076e-16 17 55.845 0.000832993 -3.87176 55.845000 Fe 0.461036 0.69287 0.5 18 55.845 0.000129305 -3.88177 55.845000 Fe 0.536804 0.719238 0.5 22 55.845 9.85073e-05 -3.88293 55.845000 Fe 0.415467 0.726898 0.5 43 55.845 0.000484042 -3.87707 55.845000 Fe 0.597718 0.715468 8.64305e-17 229 55.845 0.000970707 -3.87997 55.845000 Fe 0.582436 0.68521 0.5 231 55.845 0.000434604 -3.87924 55.845000 Fe 0.718835 0.707968 0 199 55.845 0.000774655 -3.88061 55.845000 Fe 0.764365 0.673815 2.15648e-16 200 55.845 0.00188862 -3.87534 55.845000 Fe 0.703715 0.677382 0.5 201 55.845 0.00278099 -3.89061 55.845000 Fe 0.779199 0.704081 0.5 206 55.845 0.000795188 -3.88054 55.845000 Fe 0.643087 0.681401 4.30869e-16 230 55.845 0.000994439 -3.88024 55.845000 Fe 0.658286 0.711602 0.5 236 55.845 0.00115232 -3.88098 55.845000 Fe 0.961036 0.69287 2.20355e-16 132 55.845 0.000129305 -3.88177 55.845000 Fe 0.976042 0.722987 0.5 138 55.845 0.000841302 -3.87207 55.845000 Fe 0.839671 0.700479 2.19071e-16 166 55.845 0.00138925 -3.87864 55.845000 Fe 0.824807 0.669914 0.5 168 55.845 0.00206391 -3.88659 55.845000 Fe 0.915467 0.726898 0 171 55.845 0.000484042 -3.87707 55.845000 Fe 0.854886 0.730679 0.5 172 55.845 0.00106802 -3.87904 55.845000 Fe 0.900167 0.696588 0.5 173 55.845 0.00125565 -3.88033 55.845000 Fe 0.112322 0.745673 2.06235e-16 102 55.845 0.000660302 -3.87794 55.845000 Fe 0.187271 0.772253 1 107 55.845 0.00339993 -3.87325 55.845000 Fe 0.126863 0.776133 0.5 108 55.845 0.0053861 -3.88009 55.845000 Fe 0.173119 0.742109 0.5 109 55.845 0.00113077 -3.88604 55.845000 Fe 0.0665245 0.779805 1.21088e-16 141 55.845 0.00519026 -3.84954 55.845000 Fe 0.00740082 0.783584 0.5 142 55.845 0.00584607 -3.86389 55.845000 Fe 0.0518667 0.749398 0.5 143 55.845 0.00248615 -3.87358 55.845000 Fe 0.386133 0.790785 3.96639e-16 40 55.845 0.0142413 -3.85342 55.845000 Fe 0.370566 0.761066 0.5 42 55.845 0.00261108 -3.89264 55.845000 Fe 0.233636 0.738249 3.77384e-16 68 55.845 0.00158105 -3.87769 55.845000 Fe 0.262886 0.79844 4.31297e-16 72 55.845 0.0139021 -3.88262 55.845000 Fe 0.309402 0.764682 5.58803e-16 73 55.845 0.00445788 -3.88128 55.845000 Fe 0.248363 0.768842 0.5 74 55.845 0.00747446 -3.90396 55.845000 Fe 0.294289 0.734688 0.5 75 55.845 0.00284475 -3.88939 55.845000 Fe 0.324897 0.795046 0.5 79 55.845 0.00930829 -3.90919 55.845000 Fe 0.507401 0.783584 1.71149e-18 20 55.845 0.00584607 -3.86389 55.845000 Fe 0.4913 0.7533 0.5 21 55.845 0.00175019 -3.87257 55.845000 Fe 0.431232 0.757011 2.13509e-16 41 55.845 0.00203312 -3.86378 55.845000 Fe 0.446807 0.787638 0.5 47 55.845 0.00898535 -3.89825 55.845000 Fe 0.551867 0.749398 4.36431e-16 252 55.845 0.00248615 -3.87358 55.845000 Fe 0.566525 0.779805 0.5 254 55.845 0.00519026 -3.84954 55.845000 Fe 0.748363 0.768842 3.16626e-16 203 55.845 0.00747446 -3.90396 55.845000 Fe 0.794289 0.734688 2.15648e-16 204 55.845 0.00284475 -3.88939 55.845000 Fe 0.733636 0.738249 0.5 205 55.845 0.00158105 -3.87769 55.845000 Fe 0.762886 0.79844 0.5 209 55.845 0.0139021 -3.88262 55.845000 Fe 0.626863 0.776133 2.1736e-16 233 55.845 0.0053861 -3.88009 55.845000 Fe 0.673119 0.742109 4.28729e-16 234 55.845 0.00113077 -3.88604 55.845000 Fe 0.612322 0.745673 0.5 235 55.845 0.000660302 -3.87794 55.845000 Fe 0.687271 0.772253 0.5 240 55.845 0.00339993 -3.87325 55.845000 Fe 0.9913 0.7533 2.90098e-16 136 55.845 0.00175019 -3.87257 55.845000 Fe 0.870566 0.761066 2.14793e-16 170 55.845 0.00261108 -3.89264 55.845000 Fe 0.946807 0.787638 5.47678e-16 175 55.845 0.00898535 -3.89825 55.845000 Fe 0.886133 0.790785 0.5 176 55.845 0.0142413 -3.85342 55.845000 Fe 0.931232 0.757011 0.5 177 55.845 0.00203312 -3.86378 55.845000 Fe 0.824897 0.795046 2.98228e-16 208 55.845 0.00930829 -3.90919 55.845000 Fe 0.809402 0.764682 0.5 210 55.845 0.00445788 -3.88128 55.845000 Fe 0.140922 0.806333 2.74267e-16 106 55.845 0.0323342 -3.80734 55.845000 Fe 0.159127 0.838294 0.5 112 55.845 0.133748 -3.9138 55.845000 Fe 0.0225434 0.814468 4.31297e-16 140 55.845 0.0103141 -3.89073 55.845000 Fe 0.0979675 0.841498 3.6027e-16 145 55.845 0.0195672 -3.89206 55.845000 Fe 0.0378327 0.844657 0.5 146 55.845 0.0202867 -3.86383 55.845000 Fe 0.0830422 0.81077 0.5 147 55.845 0.01657 -3.87172 55.845000 Fe 0.291712 0.856666 3.15771e-16 76 55.845 0.668002 -3.56 55.845000 Fe 0.339801 0.824048 1.81846e-16 77 55.845 0.058912 -3.82834 55.845000 Fe 0.278083 0.828804 0.5 78 55.845 0.0795629 -3.92031 55.845000 Fe 0.353134 0.855677 0.5 83 55.845 0.374801 -3.94437 55.845000 Fe 0.215712 0.832106 2.16932e-16 111 55.845 0.16167 -3.76634 55.845000 Fe 0.201609 0.802934 0.5 113 55.845 0.0335365 -3.90547 55.845000 Fe 0.239623 0.864486 0.5 117 55.845 0.452205 -3.86497 55.845000 Fe 0.400941 0.821718 0.5 46 55.845 0.0398143 -3.92631 55.845000 Fe 0.537833 0.844657 1.97678e-16 23 55.845 0.0202867 -3.86383 55.845000 Fe 0.522543 0.814468 0.5 24 55.845 0.0103141 -3.89073 55.845000 Fe 0.41535 0.850374 2.13937e-18 44 55.845 0.138447 -3.82835 55.845000 Fe 0.462395 0.817338 4.27874e-18 45 55.845 0.0294439 -3.85389 55.845000 Fe 0.476244 0.848663 0.5 51 55.845 0.0538773 -3.91465 55.845000 Fe 0.583042 0.81077 7.27385e-18 253 55.845 0.01657 -3.87172 55.845000 Fe 0.597967 0.841498 0.5 258 55.845 0.0195672 -3.89206 55.845000 Fe 0.778083 0.828804 5.65221e-16 207 55.845 0.0795629 -3.92031 55.845000 Fe 0.791712 0.856666 0.5 213 55.845 0.668002 -3.56 55.845000 Fe 0.659127 0.838294 2.19499e-16 237 55.845 0.133748 -3.9138 55.845000 Fe 0.701609 0.802934 1 238 55.845 0.0335365 -3.90547 55.845000 Fe 0.640922 0.806333 0.5 239 55.845 0.0323342 -3.80734 55.845000 Fe 0.739623 0.864486 1.81418e-16 242 55.845 0.452205 -3.86497 55.845000 Fe 0.715712 0.832106 0.5 244 55.845 0.16167 -3.76634 55.845000 Fe 0.900941 0.821718 4.48412e-16 174 55.845 0.0398143 -3.92631 55.845000 Fe 0.976244 0.848663 5.5538e-16 179 55.845 0.0538773 -3.91465 55.845000 Fe 0.91535 0.850374 0.5 180 55.845 0.138447 -3.82835 55.845000 Fe 0.962395 0.817338 0.5 181 55.845 0.0294439 -3.85389 55.845000 Fe 0.853134 0.855677 3.62409e-16 212 55.845 0.374801 -3.94437 55.845000 Fe 0.839801 0.824048 0.5 214 55.845 0.058912 -3.82834 55.845000 Fe 0.175455 0.867768 2.40037e-16 110 55.845 0.082836 -3.96639 55.845000 Fe 0.194757 0.897232 0.5 116 55.845 0.147248 -3.83122 55.845000 Fe 0.0506784 0.875827 2.6956e-16 144 55.845 0.0563586 -3.89566 55.845000 Fe 0.127156 0.901893 4.27874e-19 149 55.845 0.112073 -3.99874 55.845000 Fe 0.0606102 0.905625 0.5 150 55.845 0.338651 -3.93625 55.845000 Fe 0.113039 0.872439 0.5 151 55.845 0.103554 -3.93155 55.845000 Fe 0.143168 0.928442 0.5 155 55.845 0.479029 -3.77722 55.845000 Fe 0.331094 0.922417 2.13937e-18 80 55.845 3.30944 -4.01376 55.845000 Fe 0.363893 0.882174 1 81 55.845 5.42898 -3.41345 55.845000 Fe 0.320345 0.894019 0.5 82 55.845 5.82491 -3.86125 55.845000 Fe 0.397559 0.926012 0.5 87 55.845 6.67106 -3.97775 55.845000 Fe 0.209312 0.925661 1.28362e-18 114 55.845 0.48646 -3.79842 55.845000 Fe 0.256904 0.892728 8.08681e-17 115 55.845 4.58536 -3.88368 55.845000 Fe 0.269863 0.925544 0.5 121 55.845 0.179409 -3.70653 55.845000 Fe 0.430937 0.908525 1.32641e-17 48 55.845 6.34753 -3.41616 55.845000 Fe 0.489068 0.877632 1 49 55.845 0.158134 -3.83463 55.845000 Fe 0.426659 0.882543 0.5 50 55.845 4.23906 -3.85225 55.845000 Fe 0.496998 0.909271 0.5 55 55.845 2.57394 -3.75872 55.845000 Fe 0.56061 0.905625 3.46578e-17 255 55.845 0.338651 -3.93625 55.845000 Fe 0.550678 0.875827 0.5 257 55.845 0.0563586 -3.89566 55.845000 Fe 0.694757 0.897232 1.24939e-16 241 55.845 0.147248 -3.83122 55.845000 Fe 0.675455 0.867768 0.5 243 55.845 0.082836 -3.96639 55.845000 Fe 0.769863 0.925544 1 246 55.845 0.179409 -3.70653 55.845000 Fe 0.709312 0.925661 0.5 247 55.845 0.48646 -3.79842 55.845000 Fe 0.756904 0.892728 0.5 248 55.845 4.58536 -3.88368 55.845000 Fe 0.613039 0.872439 2.04951e-16 256 55.845 0.103554 -3.93155 55.845000 Fe 0.643168 0.928442 2.13937e-18 260 55.845 0.479029 -3.77722 55.845000 Fe 0.627156 0.901893 0.5 262 55.845 0.112073 -3.99874 55.845000 Fe 0.996998 0.909271 2.22066e-16 183 55.845 2.57394 -3.75872 55.845000 Fe 0.926659 0.882543 1.46333e-16 178 55.845 4.23906 -3.85225 55.845000 Fe 0.930937 0.908525 0.5 184 55.845 6.34753 -3.41616 55.845000 Fe 0.989068 0.877632 0.5 185 55.845 0.158134 -3.83463 55.845000 Fe 0.820345 0.894019 2.56724e-18 211 55.845 5.82491 -3.86125 55.845000 Fe 0.897559 0.926012 1.62592e-17 216 55.845 6.67106 -3.97775 55.845000 Fe 0.831094 0.922417 0.5 217 55.845 3.30944 -4.01376 55.845000 Fe 0.863893 0.882174 0.5 218 55.845 5.42898 -3.41345 55.845000 Fe 0.0691863 0.934487 1.29646e-16 148 55.845 10.8627 -3.89483 55.845000 Fe 0.152789 0.956295 4.4071e-17 153 55.845 1.66202 -3.71585 55.845000 Fe 0.0796427 0.956323 0.5 154 55.845 1.55262 -3.41732 55.845000 Fe 0.144081 0.983909 0.5 156 55.845 10.5695 -3.76275 55.845000 Fe 0.0685304 0.977741 1.28362e-18 186 55.845 10.6504 -3.88109 55.845000 Fe 0.332462 0.989267 1 84 55.845 2.98712 -4.01901 55.845000 Fe 0.398036 0.955628 2.18216e-16 85 55.845 2.6168 -4.1285 55.845000 Fe 0.335107 0.95597 0.5 86 55.845 0.0229333 -3.66489 55.845000 Fe 0.210687 0.986598 1 118 55.845 0.578213 -3.78598 55.845000 Fe 0.275869 0.955957 2.1736e-16 119 55.845 0.200436 -3.88338 55.845000 Fe 0.21316 0.956081 0.5 120 55.845 0.240139 -3.67149 55.845000 Fe 0.270907 0.986487 0.5 122 55.845 0.170726 -3.69206 55.845000 Fe 0.399347 0.985561 0.5 88 55.845 6.9604 -3.98964 55.845000 Fe 0.492951 0.976225 3.19622e-16 52 55.845 4.48737 -3.69848 55.845000 Fe 0.494464 0.935801 2.5758e-16 53 55.845 4.64695 -3.65712 55.845000 Fe 0.47124 0.955726 0.5 54 55.845 8.53448 -3.93249 55.845000 Fe 0.56853 0.977741 0.5 56 55.845 10.6504 -3.88109 55.845000 Fe 0.579643 0.956323 2.13937e-18 259 55.845 1.55262 -3.41732 55.845000 Fe 0.569186 0.934487 0.5 261 55.845 10.8627 -3.89483 55.845000 Fe 0.71316 0.956081 2.13937e-18 245 55.845 0.240139 -3.67149 55.845000 Fe 0.770907 0.986487 4.32152e-16 249 55.845 0.170726 -3.69206 55.845000 Fe 0.710687 0.986598 0.5 250 55.845 0.578213 -3.78598 55.845000 Fe 0.775869 0.955957 0.5 251 55.845 0.200436 -3.88338 55.845000 Fe 0.644081 0.983909 2.17788e-16 263 55.845 10.5695 -3.76275 55.845000 Fe 0.652789 0.956295 0.5 265 55.845 1.66202 -3.71585 55.845000 Fe 0.994464 0.935801 0.5 188 55.845 4.64695 -3.65712 55.845000 Fe 0.97124 0.955726 2.18216e-16 182 55.845 8.53448 -3.93249 55.845000 Fe 0.992951 0.976225 0.5 187 55.845 4.48737 -3.69848 55.845000 Fe 0.835107 0.95597 1.52751e-16 215 55.845 0.0229333 -3.66489 55.845000 Fe 0.899347 0.985561 2.18216e-16 219 55.845 6.9604 -3.98964 55.845000 Fe 0.832462 0.989267 0.5 220 55.845 2.98712 -4.01901 55.845000 Fe 0.898036 0.955628 0.5 221 55.845 2.6168 -4.1285