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=13.755844315509506 stress="-1.7476839526679453 -0.1399669657991492 -0.002992709308168726 -0.1399669657991492 -1.750015446483811 -0.1294110070069014 -0.002992709308168726 -0.1294110070069014 -2.147498162037122" pbc="T F T" Fe 0.03848316 0.19178619 0.17895518 8.19360360 -16.32675181 -9.67876026 Fe 1.79140871 1.61455359 0.03253581 -12.49957184 14.07283713 -2.58412709 Fe 1.64904689 0.10609294 1.46603997 -13.73795597 -20.30599563 5.49886404 Fe -0.19401975 1.32157598 1.51361598 18.04392422 22.55991030 6.76402331