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=-6.462598860638668 stress="-10.200141270785124 -3.4391856523876383 5.429607277349099 -3.4391856523876383 -8.691985330912612 -1.6437145334359995 5.429607277349099 -1.6437145334359995 -12.304648444338508" pbc="F F F" Fe 0.13132919 0.25978669 -0.27407488 -3.50131453 -4.21407179 -1.91815293 Fe 1.28504734 1.68365717 0.20288723 8.28837036 4.48277965 -5.78965402 Fe 1.40526828 -0.20414597 1.66028707 0.90067753 -1.44267872 0.47223669 Fe 0.22094491 1.65656920 1.68190327 -5.68773336 1.17397085 7.23557025