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=-1.6752493451552686 stress="-1.941330739462334 0.35850537942108585 -0.42284044632938106 0.35850537942108585 -1.8246549554481621 -0.19929554425592175 -0.42284044632938106 -0.19929554425592175 -1.8209214092771209" pbc="T T T" Fe -0.14459490 0.11115480 -0.01275680 15.99557216 -16.71299531 -1.43985620 Fe 1.70960170 1.31143450 0.04092907 -26.85720310 16.06951024 -9.94926198 Fe 1.35333724 0.05786860 1.64041416 -3.47771395 -4.92453842 -2.56495191 Fe -0.22187219 1.51878885 1.32834452 14.33934488 5.56802349 13.95407008