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=1.5645934628700822 stress="-8.908645072093917 0.4950762653129488 -2.6774101818897513 0.4950762653129488 -12.278609902116903 -5.308870392180787 -2.6774101818897513 -5.308870392180787 -11.901450511893024" pbc="F F F" Fe -0.14459490 0.11115480 0.11044915 -3.97254597 -6.67338611 -7.70834019 Fe 1.70960170 1.31143450 -0.16166483 2.15182854 1.49426601 -0.97246844 Fe 1.28829595 -0.16490224 1.64041416 3.35024417 -1.89747806 3.41113484 Fe -0.22187219 1.51878885 1.32834452 -1.52952674 7.07659816 5.26967379