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=9.165937067905297 stress="-2.9188173952006973 0.0006868251914421132 0.20263569751786872 0.0006868251914421132 -3.2961223156851625 -0.19360567894488123 0.20263569751786872 -0.19360567894488123 -3.1762109391746156" pbc="F F T" Mo 0.10170120 0.00082602 0.24624097 -24.52940714 -32.79968008 -19.24854052 Mo 1.64302402 1.35498893 0.11042859 29.79057018 29.20544541 -25.10873903 Mo 1.70947124 0.05280714 1.41333883 21.33755409 -29.09122042 19.85759936 Mo 0.15488783 1.55988540 1.20245745 -26.59871714 32.68545509 24.49968019