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:Z:I:1:forces:R:3 energy=164.639630437 pbc="T F T" Mo 0.12418668 -0.09051133 0.19462846 42 -95.49199124 -146.43798172 -93.69933573 Mo 1.16337955 1.27846858 0.17817145 42 121.55715810 160.49383313 -138.34685307 Mo 1.42470151 0.06235191 1.31668137 42 104.90847020 -140.48353085 111.42159595 Mo 0.15157940 1.24396547 1.41257404 42 -130.97363706 126.42767944 120.62459285