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=918.7169038215795 stress="-3984.040075433795 946.9819326708188 1605.961934708949 946.9819326708188 -3663.0009495357526 1115.6207605765987 1605.961934708949 1115.6207605765987 -4093.906109186833" pbc="F F F" Fm -0.11211219 -0.20527979 -0.23624150 -470.84478727 -443.59830485 -363.08126187 Fm 1.36082354 1.41805985 0.09312927 1777.10550171 1267.70869424 -2435.61341567 Fm 1.33668805 -0.00170086 1.54355613 1059.08936512 -2000.08611909 1293.97449460 Fm -0.04111592 1.50585635 1.48707773 -2365.35007956 1175.97572969 1504.72018294