4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=18.754594580217994 stress="-2.3889611756225766 0.13846187004545743 0.02183204534919546 0.13846187004545743 -2.14742810268978 -0.017791391742796675 0.02183204534919546 -0.017791391742796675 -2.0227328229068027" pbc="T F F" Fe -0.14801295 0.06329927 0.09073906 12.84847389 -26.02335344 -19.27549016 Fe 1.77219963 1.43381326 0.13132919 -15.26813501 22.49363594 -17.98795741 Fe 1.75978669 0.18365717 1.70288723 -12.77144159 -20.50189733 18.69824097 Fe 0.08343331 1.29585403 1.44809454 15.19110271 24.03161483 18.56520659