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=95.48620702654912 stress="-222.28465784328014 24.81834703962297 -51.99940823821308 24.81834703962297 -184.7944635589079 -26.0008269052811 -51.99940823821308 -26.0008269052811 -239.86910010893024" pbc="F F F"
Mo       0.19178619       0.17895518       0.29140871     -98.08054076     -82.13791363    -159.75218503 
Mo       1.61455359       1.53253581       0.14904689      45.53915242      56.77946377     -36.96452026 
Mo       1.28091226       0.10609294       1.46603997     120.52339684     -64.96494502     122.36889206 
Mo      -0.19401975       1.32157598       1.51361598     -67.98200850      90.32339488      74.34781323