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=9.165939637193572 stress="-2.918724314813327 0.000721903565790062 0.20265921042148574 0.000721903565790062 -3.296104442156758 -0.19359202754979513 0.20265921042148574 -0.19359202754979513 -3.176204030346014" pbc="F F T" Mo 0.10170120 0.00082602 0.24624097 -24.52821464 -32.79866188 -19.24777809 Mo 1.64302402 1.35498893 0.11042859 29.78938836 29.20563865 -25.10854195 Mo 1.70947124 0.05280714 1.41333883 21.33710959 -29.09197980 19.85702841 Mo 0.15488783 1.55988540 1.20245745 -26.59828330 32.68500303 24.49929163