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=-0.1658950232853904 stress="-33.53005418764776 -0.4412576790644076 26.707508967896857 -0.4412576790644076 -13.745036681217355 4.711492879512383 26.707508967896857 4.711492879512383 -41.12642281764192" pbc="F F F" Fe 0.27500470 -0.13833825 -0.09601473 -2.26935750 -3.43881239 -2.48408152 Fe 1.28802619 1.68051743 0.18584377 26.70184951 7.19550356 -31.28911044 Fe 1.60214968 0.19581920 1.60474345 4.76401204 -5.15420752 3.88108925 Fe 0.26959405 1.56451915 1.35402479 -29.19650405 1.39751635 29.89210272