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=47.65641903967293 stress="-183.24408770690638 19.110579758757737 -27.690069554696976 19.110579758757737 -160.0243238880084 -15.451563298549786 -27.690069554696976 -15.451563298549786 -183.36653587089052" pbc="F F F" Mo 0.19178619 0.17895518 0.29140871 -73.18114737 -68.15402708 -115.92672273 Mo 1.61455359 1.53253581 0.14904689 42.05301058 51.76348209 -33.69688011 Mo 1.28091226 0.10609294 1.46603997 91.81565946 -58.60229812 90.41675538 Mo -0.19401975 1.32157598 1.51361598 -60.68752267 74.99284311 59.20684746