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=5.1605404836955024 stress="-2.0846932802558023 0.016927377291512242 -0.5882428148586513 0.016927377291512242 -2.0309606964100646 -0.2947867562270271 -0.5882428148586513 -0.2947867562270271 -1.7898594154757714" pbc="F T F" Fe 0.15720406 -0.23435154 0.29768454 -33.62576840 4.23654497 -23.19301209 Fe 1.48273691 1.36065667 0.17089611 9.69631198 -13.38252344 -20.21209203 Fe 1.47011124 -0.29779682 1.21755886 33.87911940 13.51284256 31.55461210 Fe 0.26235339 1.34838096 1.71005355 -9.94966298 -4.36686409 11.85049202