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=43.93405092256374 stress="-3.1283974634798204 0.37633344682466396 -0.8238108957657765 0.37633344682466396 -5.031081608815899 -0.014820639961516288 -0.8238108957657765 -0.014820639961516288 -3.426479049232018" pbc="F T F" Sm 0.04737131 0.03238783 0.24404962 -35.33215870 -15.47141848 -39.82523233 Al 1.36810690 1.39130086 0.09119645 27.05732052 7.49786807 -24.03011210 Sm 1.29640878 0.21456242 1.77913633 42.81928914 -19.03807074 40.66345508 Al 0.18492541 1.33178173 1.38323780 -34.54445096 27.01162115 23.19188935