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=-36.26080435002243 stress="-2.6239629972293352 0.2810527901211465 -0.35659474391743234 0.2810527901211465 -3.1245281535077307 -0.32899946829650506 -0.35659474391743234 -0.32899946829650506 -3.135898873449441" pbc="T T T" Fe -0.14459490 0.11115480 0.11044915 15.34258376 -20.37265638 -4.39858446 Fe 1.70960170 1.31143450 -0.16166483 -25.90100381 22.23029812 5.11162401 Fe 1.28829595 0.03769167 1.64041416 -3.72365938 -11.07914757 -9.80668048 Fe -0.22187219 1.51878885 1.32834452 14.28207943 9.22150584 9.09364094