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=-6.060078167696394 stress="-17.922197287835257 -0.6052781994012322 -0.02535609282557072 -0.6052781994012322 -23.228855195551294 -7.6382780963722094 -0.02535609282557072 -7.6382780963722094 -21.05644801427929" pbc="F F F" Fe -0.14459490 0.11115480 0.11044915 -6.59476442 -11.25996552 -10.49308681 Fe 1.58639575 1.27038270 0.04092907 7.24882786 3.48425346 -5.16878401 Fe 1.28829595 -0.09986095 1.64041416 4.24865426 -5.09341443 5.19946066 Fe 0.00089865 1.51878885 1.32834452 -4.90271770 12.86912649 10.46241015