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=2.307266087816571 stress="-1.4390147636062591 -0.04191937393933837 -0.21875222910779507 -0.04191937393933837 -1.888217666050923 -0.42680236859975734 -0.21875222910779507 -0.42680236859975734 -1.748366730869114" pbc="F T F" Fe 0.07034430 0.04852473 0.05473499 -18.36017084 3.48113291 -17.39998864 Fe 1.41561068 1.63661615 0.11041876 10.78917134 -15.45712433 -20.96345591 Fe 1.26735611 -0.16466555 1.24148635 20.50360673 18.40175552 28.36229903 Fe 0.08611608 1.53369179 1.52598936 -12.93260723 -6.42576410 10.00114552