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=-2.9733940081357138 stress="-29.62103563548845 -5.15390444361988 -1.35753200186309 -5.15390444361988 -49.64718299361982 9.1315644813338 -1.35753200186309 9.1315644813338 -50.118244795546104" pbc="F F F" Fe -0.12280496 -0.20130994 0.11041876 -10.54568306 -22.31518086 -6.74833596 Fe 1.26735611 1.33533445 -0.25851365 8.11749430 21.87881172 -23.36912021 Fe 1.58611608 0.33244006 1.52598936 10.04397098 -13.52466514 20.65653916 Fe -0.27670350 1.46375436 1.40583543 -7.61578221 13.96103428 9.46091701