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=33.1808018237027 stress="-4.881635091694936 0.4230091370143497 1.920692023796866 0.4230091370143497 -3.784665093462039 1.088979926734366 1.920692023796866 1.088979926734366 -5.626735767630695" pbc="F F T" Fe 0.29874826 0.05835534 -0.25354363 -50.66423235 -35.14197227 31.66173881 Fe 1.48193431 1.42001865 0.20070203 44.36162272 36.27700060 -32.09469778 Fe 1.20342959 0.28187239 1.51001192 73.11966045 -49.52885167 -12.52520404 Fe 0.10170120 1.37793365 1.21904386 -66.81705082 48.39382335 12.95816301