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=2.3070275873603623 stress="-1.373905421502876 0.0593718085277133 -0.0008722163590727569 0.0593718085277133 -1.5282786667753774 -0.06358086772968298 -0.0008722163590727569 -0.06358086772968298 -1.8738973322383172" pbc="T F T" Fe 0.15300231 0.03848316 -0.04225341 -12.74769101 -12.20205680 7.39091577 Fe 1.41852158 1.45789336 -0.11174318 13.13522745 14.37076745 9.03801625 Fe 1.27041603 0.19178619 1.67895518 13.80164453 -17.06782901 -10.38903821 Fe 0.29140871 1.61455359 1.53253581 -14.18918097 14.89911836 -6.03989381