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=-37.75305632735182 stress="-2.7383174444131293 0.021304066840498907 0.07562549672233122 0.021304066840498907 -3.3165006994245516 -0.21124287601900327 0.07562549672233122 -0.21124287601900327 -3.780767271684267" free_energy=-37.75305632735182 pbc="T F T"
Mo       0.03848316       0.19178619       0.17895518      33.78786033     -31.12677533     -23.54732576 
Mo       1.79140871       1.61455359       0.03253581     -31.33258088      33.06718975     -10.85182725 
Mo       1.64904689       0.10609294       1.46603997     -38.48487642     -36.76798839      14.57908272 
Mo       2.80598025       1.32157598       1.51361598      36.02959698      34.82757397      19.82007028