32 Lattice="6.582385030069556 0.0 0.0 0.0 6.582385030069556 0.0 0.0 0.0 6.582385030069556" Properties=species:S:1:pos:R:3:forces:R:3 energy=-103.65147578103124 stress="-0.041592912444953736 -0.007085979180298381 -0.008458020343603954 -0.007085979180298381 -0.04185518382287313 -0.0056232413760654255 -0.008458020343603954 -0.0056232413760654255 -0.04369324889530984" pbc="F F F" Fe 0.02751496 0.05105680 0.02298965 -0.35188965 -0.72575421 -0.39962895 Fe 1.63234715 1.65378753 0.02694775 1.18982114 0.79399215 -1.31112753 Fe 1.67779439 0.01015575 1.64489798 -0.72433284 -1.55314200 0.69316990 Fe 0.02839455 1.62011958 1.65853487 -1.37762889 1.16578666 0.47337949 Fe 3.28193004 0.01998672 0.02985425 -0.49741651 -0.88883905 -1.23818475 Fe 4.90943571 1.62597893 0.01614587 0.52636771 1.00322876 -0.81077673 Fe 4.93242985 0.02531582 1.61288823 0.69655400 -0.74574857 1.04097264 Fe 3.27112936 1.62105680 1.64136633 0.32623561 2.48210264 0.73646868 Fe 0.01437319 3.29870670 0.01513332 -0.69905263 -0.72864680 -0.51933267 Fe 1.61782208 4.95045065 0.00133245 1.05682035 0.14562358 -0.43642059 Fe 1.63224819 3.28659686 1.63590628 1.26370759 -0.05295265 0.91898274 Fe 0.01283714 4.93966106 1.61348678 -0.42154113 0.47272376 1.08820299 Fe 3.31607515 3.31925612 0.01774339 -1.43466598 -0.95836755 -0.89109212 Fe 4.92024605 4.94789263 0.00344973 0.14325314 0.35091596 0.04285866 Fe 4.92820312 3.30168852 1.61711571 0.58420962 -1.00861219 0.95046600 Fe 3.27310833 4.93272979 1.65335384 -0.57964514 0.61475319 0.27959649 Fe 0.00998573 0.03874086 3.32207521 -0.70043822 -0.90889510 -0.99792313 Fe 1.64457052 1.63850102 3.26502245 0.55890435 1.08965718 0.29146334 Fe 1.62235804 0.01769415 4.91486412 1.22727203 -0.38563681 0.46348642 Fe 0.01440238 1.65534811 4.93731329 -0.50963295 0.74790466 0.27425252 Fe 3.31163772 0.02563127 3.26246631 -0.42226930 -0.90062058 0.58095865 Fe 4.94966309 1.65687793 3.28639666 0.33181963 0.22705597 -0.57569784 Fe 4.90316231 0.00220259 4.94540668 -0.20248863 0.37124684 -0.18341616 Fe 3.26492742 1.67480790 4.91580071 -0.14892430 -0.68944950 0.80466447 Fe 0.01427524 3.31199767 3.27594507 -0.75259742 -1.00595431 -0.66205687 Fe 1.64678448 4.94644560 3.30938202 0.43620237 0.48911646 -1.07287086 Fe 1.62487654 3.29007770 4.92415930 0.69264534 -0.41782369 0.69591816 Fe 0.00995697 4.90613158 4.90659302 -0.44896743 0.49638054 0.50162484 Fe 3.27232554 3.27432641 3.29754597 -0.28695750 0.16619451 -1.47923055 Fe 4.94071017 4.92074703 3.23849404 -0.03449961 0.15321584 0.44558816 Fe 4.90497238 3.28621890 4.91929714 0.51073275 0.11073116 0.31612684 Fe 3.27170080 4.93322659 4.94300766 0.04840249 0.08981317 -0.02042225