4 Lattice="2.8369121544592115 0.0 0.0 1.4184560772296058 2.45683799406652 0.0 0.0 0.0 14.632657261921032" Properties=species:S:1:pos:R:3:tags:I:1:forces:R:3:magmoms:R:1 energy=-33.374199051066036 magmom=0.0 pbc="T T F" Mo 1.41845608 0.81894600 4.99999956 3 0.00000000 0.00000000 0.52665964 0.00000000 Mo 0.00000000 1.63789200 7.31632863 2 -0.00000000 0.00000000 -1.07949794 0.00000000 Mo -0.00000000 -0.00000000 9.61209709 1 -0.00000000 0.00000000 0.54405388 0.00000000 H -0.00000000 0.00000000 11.34329745 0 0.00000000 0.00000000 0.00887228 0.00000000