64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=117.0055253819916 stress="-592.5299281166772 -52.680347037136926 -253.16057254421037 -52.680347037136926 -572.9146856019645 -16.815980160675736 -253.16057254421037 -16.815980160675736 -468.4587084661579" pbc="F F F" Fe 0.22086729 -0.01689004 -0.22903346 -1.94384004 -1.47242996 -2.19742800 Fe 1.59933616 0.93572417 0.98055861 -15.34178317 -41.33546715 27.92226232 Fe 2.14715992 2.22516294 0.23402360 -2.50093801 14.21903838 -49.79780786 Fe 2.93229823 3.31172061 1.19084223 19.00626895 27.17671743 24.04040115 Fe 2.29465675 0.14771729 3.20399864 -4.85285674 -1.72148911 -0.99809627 Fe 3.85840215 1.26405997 3.83490027 -0.49039548 -0.98881172 7.24427217 Fe -0.23115740 3.20444678 3.02575960 0.18709229 -0.64321618 -0.86024467 Fe 1.55604684 4.07636534 3.99475015 -40.69779978 103.85760089 -60.62828475 Fe 5.23975440 0.55577733 0.25284888 -2.44436364 0.33252066 -2.02127456 Fe 6.57116719 1.00454661 1.78983070 -12.90961270 10.79538831 -10.96468803 Fe 7.51432400 1.93324962 -0.30384491 -0.62419414 -0.36396302 1.24855362 Fe 8.42712388 3.91385061 1.22088890 8.04608912 -13.36872604 -12.18906670 Fe 7.81964364 0.29825864 2.90182602 15.09265878 -8.17769525 13.76158828 Fe 8.94092265 1.79747090 4.26025248 27.76570645 -11.60228290 -29.86575675 Fe 4.61890133 2.43827487 2.40447350 2.95141440 5.15940493 -7.66553185 Fe 6.32868209 3.48931485 3.46659910 1.29551024 -0.15341091 1.30992900 Fe -0.27058365 4.65017747 0.17843495 -4.92617773 -9.42352830 -3.92691401 Fe 0.67994952 6.20201413 0.91957267 -8.40837762 -4.95720628 15.21798831 Fe 1.83832478 7.32454839 0.07964709 14.44193114 13.65654672 -9.68453559 Fe 3.61643991 8.32327578 1.40123177 -70.29495499 41.46733376 -47.14516414 Fe 2.95366604 4.88968876 2.71888199 -26.32211152 -18.37622459 -17.61330929 Fe 4.18297782 5.79320854 3.39174556 30.46750213 22.47187872 14.52188351 Fe 0.30302897 7.83814538 2.63905551 -2.73333359 -7.09015096 -8.44003719 Fe 0.93114464 8.99801325 4.11824152 4.23461906 5.92364542 9.27565984 Fe 5.10049303 5.54851891 -0.14790264 -0.59811669 0.77834249 1.32791913 Fe 6.60365422 6.12475624 1.46651109 -22.00103698 24.85388396 -19.02338398 Fe 7.06544791 8.43063630 0.46577408 -35.54894608 -9.12873050 -11.62720530 Fe 8.61612729 8.80145122 1.02098422 33.96105753 7.66851241 12.76751583 Fe 7.58087455 5.09122498 2.35935114 11.19533792 -11.27403477 30.41030062 Fe 8.53127631 6.09201764 3.97117919 1.48912425 -0.00406851 1.83323089 Fe 4.66448343 7.68403127 2.11226018 70.31180209 -43.58789772 45.87488779 Fe 5.97555741 8.07655432 3.89352680 -40.17985903 6.67949901 -22.90346924 Fe 0.04263434 0.15136053 4.28249517 -6.29082688 -2.09488797 -9.42821164 Fe 1.21994698 0.60264947 5.79204899 -0.15134412 6.86974406 -3.37846317 Fe 2.00297454 2.99791377 4.62151619 44.15035663 -107.87744939 61.80015348 Fe 3.55150311 3.51894432 6.34725891 -3.56204798 -4.50108733 3.81416114 Fe 2.33719750 0.17049102 7.29388522 8.49579464 -2.32098310 11.13990247 Fe 4.08450338 0.75571598 8.99881808 -2.18565483 -3.08399938 1.81651846 Fe -0.00344088 3.21033166 7.51668654 -19.23568875 -11.74982900 -18.15487271 Fe 1.22422232 3.91950201 8.54655608 -6.63033179 -12.27360139 32.95528871 Fe 4.13213130 0.41553907 5.84226646 0.07406032 0.09972556 2.67240277 Fe 6.48837336 1.00831489 6.43404765 -36.36485708 55.52154757 -30.05463304 Fe 7.84911873 2.25854751 5.40500065 -52.68927592 -29.37375677 6.17237957 Fe 8.60556472 3.49425818 6.03735392 25.42038267 43.03244682 22.15048324 Fe 7.20384740 -0.14918067 7.03810700 36.13723665 -56.56062538 30.73253209 Fe 8.82898977 1.05759461 8.76534421 -1.17863382 -0.34838006 -1.58242750 Fe 5.09980901 2.00409575 7.77385137 0.82641107 3.33925066 -2.49557315 Fe 5.57395735 3.95693653 8.90115407 1.46435730 -1.70921463 -0.91855031 Fe -0.02543498 4.89949207 4.94651716 -3.45619355 1.90830977 3.31012895 Fe 1.16201767 6.98989951 5.74303982 -12.16671220 -1.29777040 6.55365643 Fe 2.82350393 7.21827495 4.80335328 -3.11769108 -19.69181919 -28.72883833 Fe 3.63834321 8.28337470 5.87827378 16.27127611 19.53990098 20.86008117 Fe 2.36102597 4.94186987 7.87644269 27.45660216 24.91582382 -17.31152562 Fe 4.55457252 5.79284007 8.85695185 -1.28397185 2.43694625 -1.22430963 Fe 0.06236183 7.74812411 7.77511221 -0.58129365 -1.28709475 -1.43472709 Fe 1.48115325 8.96771709 8.78828861 0.83986113 1.04429012 0.64585996 Fe 4.68857725 4.74812168 5.24335814 1.07219295 0.15450441 -3.18485742 Fe 5.89974943 6.22892384 6.12165250 33.57790190 -51.19157866 -60.73163991 Fe 7.34497277 7.80178516 4.71375535 38.90722008 -7.20915323 25.28758637 Fe 8.54610002 8.89496231 6.59964402 -1.51634410 -1.72162549 0.11563482 Fe 7.83394746 5.70480081 7.92669675 -93.87899500 -56.03424798 -74.08546540 Fe 8.77099171 6.28111300 8.66957874 91.47370013 57.05780460 72.55260661 Fe 5.39757659 7.11536967 7.13716159 -30.33158388 53.70024791 61.29754163 Fe 5.99934153 8.70821989 8.60820831 0.82667635 -0.66441764 -0.36701725