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=-0.1658950220208113 stress="-33.53005577517344 -0.4412583346506376 26.70751406364004 -0.4412583346506376 -13.745038541180158 4.711493839457424 26.70751406364004 4.711493839457424 -41.12642256239908" pbc="F F F" Fe 0.27500470 -0.13833825 -0.09601473 -2.26935671 -3.43881293 -2.48407962 Fe 1.28802619 1.68051743 0.18584377 26.70185263 7.19550494 -31.28911299 Fe 1.60214968 0.19581920 1.60474345 4.76401085 -5.15420808 3.88108737 Fe 0.26959405 1.56451915 1.35402479 -29.19650677 1.39751607 29.89210524