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=-5.001434381998224 stress="-2.370886423818316 -1.3895821350417534 -0.15920731712970776 -1.3895821350417534 -2.757351822719713 0.20257872929864915 -0.15920731712970776 0.20257872929864915 -2.1001714789602532" free_energy=-5.001434381998224 pbc="T F F"
Mo       0.30898017       0.01361598       0.06329927      -6.67230568     -21.92979390     -13.57408162
Mo       1.52088773       1.27846858       0.09073906       2.88510773      23.80578943     -20.84285875
Mo       1.77219963       0.13132919       1.75978669     -25.18320402     -40.49765918      19.81875644
Mo      -0.27407488       1.28504734       1.68365717      28.97040198      38.62166365      14.59818394