108 Lattice="10.560653762811974 0.0 0.0 0.0 10.560653762811974 0.0 0.0 0.0 10.560653762811974" Properties=species:S:1:pos:R:3:forces:R:3 energy=-382.2992251478999 stress="-0.007119658105314009 0.00042625120774149197 -0.000604169216567299 0.00042625120774149197 -0.007507695952234813 0.0012047515103725585 -0.000604169216567299 0.0012047515103725585 -0.007448074177401073" free_energy=-382.2992251478999 pbc="F F F" Fe 0.01985919 0.03151780 0.01114559 0.36999485 0.32487549 0.49167708 Fe 1.74356660 1.72698821 0.02395589 0.26983140 0.15403162 -0.39277468 Fe 1.77998181 0.02506472 1.78373739 -0.09895221 -0.48108287 -0.30489635 Fe 0.02656722 1.74787403 1.78325757 -0.51022801 -0.02561110 -0.03029316 Fe 3.55204512 0.03697313 0.01403372 -0.20263745 0.00237909 0.25156196 Fe 5.26583468 1.72722272 0.00128971 0.20426900 0.30466019 -0.46352759 Fe 5.30822753 0.02321514 1.76692448 -0.19166333 -0.58611505 0.03101149 Fe 3.53003215 1.77853711 1.74781964 -0.27103424 -0.33222713 -0.13721526 Fe 7.01005479 0.01473989 0.00921449 0.43335715 0.33835536 0.37978842 Fe 8.82372438 1.75898107 0.01355176 -0.54226253 -0.14440985 0.45424610 Fe 8.83159230 0.01036179 1.78724604 -0.49178157 0.36677178 -0.35530520 Fe 7.02586950 1.75342213 1.75683126 0.49409112 0.03571513 -0.18792404 Fe 0.02923117 3.47022869 0.03588472 0.06708119 0.12705086 0.01173219 Fe 1.78928596 5.24639725 0.01926817 -0.34529987 0.36640947 -0.43783810 Fe 1.72092090 3.51012159 1.76705686 0.20840498 -0.16115422 -0.09439769 Fe 0.02257869 5.25761238 1.73858976 -0.39139298 0.26168225 0.08099387 Fe 3.53755198 3.53077698 0.02817692 -0.34644374 -0.40978139 -0.66737821 Fe 5.26099573 5.25205605 0.01710997 0.14004897 0.34629220 -0.59247577 Fe 5.25852626 3.51240604 1.72932635 0.47607327 0.08217746 0.27940518 Fe 3.49639574 5.25003711 1.75721016 0.10558167 0.32592765 -0.13102470 Fe 7.04736742 3.51837561 0.00568177 0.05391281 -0.19824027 -0.34039518 Fe 8.80744474 5.25440680 0.02469054 -0.13259066 0.13768897 0.03677147 Fe 8.82243216 3.53909358 1.73393066 0.12551955 -0.26579106 0.21725615 Fe 7.03864849 5.30322539 1.71057100 0.11957311 -0.38098978 0.40126623 Fe 0.00011697 7.05570573 0.03149419 0.47618331 -0.05172417 0.35492544 Fe 1.74129129 8.81029509 0.00458902 -0.12383118 -0.39121406 0.30520141 Fe 1.76340879 7.05825456 1.76660398 -0.26403994 -0.05423564 -0.35074807 Fe 0.01081039 8.79016861 1.78907004 0.25849031 -0.25649957 -0.23370802 Fe 3.53954177 7.06679125 0.02924178 -0.17545638 -0.16569972 -0.48047035 Fe 5.28071186 8.81366338 0.03144978 0.15970196 -0.36930815 0.32907411 Fe 5.26439623 7.00592421 1.76941628 0.12660283 0.45919696 -0.36618749 Fe 3.47605051 8.78059264 1.73213887 0.23377726 0.48123091 0.22490231 Fe 7.07446689 7.02700408 0.01264872 -0.18714625 0.36279098 -0.39044637 Fe 8.82602340 8.83503458 0.02561755 -0.54676492 -0.56009820 0.49273176 Fe 8.79211675 7.04417268 1.74958921 0.44073541 0.07566147 0.00313034 Fe 7.06174740 8.78518747 1.76834581 -0.09885935 0.23543024 -0.19655383 Fe 0.02069809 0.03359371 3.51766731 0.06448107 0.10100169 0.09479301 Fe 1.76871005 1.73580452 3.53487736 -0.22472403 0.24165160 -0.02107118 Fe 1.71972963 0.02251880 5.28466229 0.17661680 -0.67936207 -0.06717425 Fe 0.00543271 1.78352605 5.30591033 -0.50492885 -0.25013910 -0.22617313 Fe 3.51229979 0.02695991 3.52235817 -0.01698993 -0.64692565 -0.07629494 Fe 5.25028977 1.73623711 3.50025322 0.31377034 0.17776745 0.23067741 Fe 5.26570142 0.00035922 5.24637913 0.27315534 -0.33767118 0.23413323 Fe 3.49428243 1.71514441 5.30551230 0.46655833 0.36473760 -0.28435042 Fe 7.09329183 0.00575385 3.52872834 -0.35185452 -0.50843250 -0.17802217 Fe 8.77510211 1.73955929 3.51428755 0.52921687 0.41328933 -0.10130512 Fe 8.79512013 0.01802740 5.26582686 -0.12500330 0.07391709 0.21830526 Fe 7.05339787 1.74079717 5.24795848 -0.13128744 0.16468690 0.40203583 Fe 0.02697412 3.53705753 3.54975043 -0.37415347 -0.12222853 -0.10449747 Fe 1.77739552 5.30731331 3.51071913 -0.27726044 -0.27640787 0.26599895 Fe 1.76596912 3.49015767 5.31187746 -0.10722558 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0.18883163 Fe 5.26093110 8.78083320 3.49415004 0.11657364 0.35058917 0.14278520 Fe 5.26894434 7.04502822 5.30913642 0.28378974 0.24567172 -0.17084781 Fe 3.53195863 8.77316726 5.30394321 -0.23007457 0.29187893 -0.19811331 Fe 7.03739913 7.02882134 3.49995428 0.18736315 0.27443255 0.32655859 Fe 8.81153632 8.81274250 3.49952406 -0.32264815 -0.45356156 0.19021744 Fe 8.80046296 7.00779906 5.29233755 0.20904570 0.66944027 -0.18459916 Fe 7.06281969 8.81001485 5.29360195 0.01589289 0.06950445 -0.27603817 Fe 0.03453979 0.01313047 7.03521729 0.13823088 0.28245057 0.20208580 Fe 1.77230929 1.73108883 7.01542245 -0.17577889 0.15761028 0.95402714 Fe 1.74030059 0.00203286 8.81388361 0.17950686 0.40523592 -0.45496256 Fe 0.03380117 1.75368774 8.80030697 0.38546716 0.02118999 -0.38969014 Fe 3.54857844 0.02634980 7.04723073 -0.17815298 -0.58588564 0.23048033 Fe 5.27719781 1.77027370 7.07023446 0.33296856 -0.12550277 -0.31834299 Fe 5.28818254 0.02154552 8.81595776 0.07254972 0.20286053 -0.19410226 Fe 3.54784594 1.75854452 8.80638270 -0.43365336 -0.07404260 0.31687052 Fe 7.02654036 0.02138587 7.05594586 0.12601436 -0.27080254 -0.17953516 Fe 8.82875696 1.75942097 7.00628637 0.09707977 0.09884979 0.24282283 Fe 8.78263048 0.02574453 8.78853624 -0.38455737 0.42189759 -0.48540815 Fe 7.07321192 1.76898777 8.77131723 0.05213375 0.10585922 0.29740961 Fe 0.00571786 3.49884057 7.05193540 -0.25261823 0.19485060 0.11204344 Fe 1.74692333 5.27786792 7.05078020 -0.19050952 -0.22805304 0.06080247 Fe 1.77319564 3.55239048 8.82536539 -0.05892073 -0.40538412 0.06824795 Fe 0.01662015 5.26782528 8.78032728 0.18950839 0.10564553 -0.15658478 Fe 3.54643941 3.51776282 7.04176810 -0.40798260 -0.14170872 0.36340427 Fe 5.25940155 5.23600067 7.01563027 0.35048742 0.38040447 0.61616570 Fe 5.27923119 3.51615662 8.80491932 0.14998530 0.20003507 0.41631170 Fe 3.49466397 5.30762886 8.81274457 0.39071714 -0.32034682 0.38782709 Fe 7.06923789 3.55392696 7.03626403 0.00265555 -0.43913413 0.21260547 Fe 8.78164505 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8.77125255 -0.12634560 -0.27954091 -0.14142098