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=1.1420754506830584 stress="-1.0791364668843497 -0.29132290178667125 0.46012954585682975 -0.29132290178667125 -2.1241545192340925 0.5920861555500485 0.46012954585682975 0.5920861555500485 -1.9810857300682043" pbc="F T T" Fe 0.22094491 0.23171545 0.18190327 -10.40081220 -3.84828390 -4.50810211 Fe 1.32183498 1.71219253 -0.07514625 7.90989848 -20.41732350 17.19915122 Fe 1.62990665 -0.21779550 1.78278197 13.28252110 21.81226562 -21.28692395 Fe 0.06210000 1.63362859 1.32702941 -10.79160737 2.45334178 8.59587484