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=18.73800006702125 stress="-2.3884347430674278 0.1384566493659383 0.021826887421834716 0.1384566493659383 -2.1474237648224492 -0.017791518231921693 0.021826887421834716 -0.017791518231921693 -2.0227267979628096" pbc="T F F" Fe -0.14801295 0.06329927 0.09073906 12.84836502 -26.02330396 -19.27543567 Fe 1.77219963 1.43381326 0.13132919 -15.26812959 22.49359104 -17.98790096 Fe 1.75978669 0.18365717 1.70288723 -12.77144701 -20.50185243 18.69818452 Fe 0.08343331 1.29585403 1.44809454 15.19121158 24.03156535 18.56515211