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=12.324786610192929 stress="-2.821912749992186 0.43246218005067827 1.1963212138788297 0.43246218005067827 -1.9990875203568625 0.7329003138993438 1.1963212138788297 0.7329003138993438 -2.988853497548987" pbc="F F T" Fe 0.29874826 0.05835534 -0.25354363 -29.93724673 -16.67891626 27.44645492 Fe 1.48193431 1.42001865 0.20070203 21.54254695 16.68960499 -14.89912032 Fe 1.20342959 0.28187239 1.51001192 47.52256098 -28.52381159 -15.56160046 Fe 0.10170120 1.37793365 1.21986988 -39.12786121 28.51312286 3.01426587