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=9.743152148853946 stress="-2.5804237221236273 0.16943997901418215 0.32638034494086027 0.16943997901418215 -2.2738755224373985 0.9452074757282504 0.32638034494086027 0.9452074757282504 -4.2791414676324955" free_energy=9.743152148853946 pbc="T F F" Fe 2.90295338 0.10338854 0.24759167 30.58801504 -15.26322418 -31.95649240 Fe 1.61018303 1.42518197 0.18843096 -19.63047117 36.44635473 -56.12747373 Cr 1.67061300 0.29169807 1.46863002 -29.75423760 -34.98558522 62.35334185 Cr 2.69426025 1.53851086 1.64982991 18.79669373 13.80245467 25.73062429