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=-2.247582007957887 stress="-1.1528160415937192 0.057595037909075456 0.014497771113433552 0.057595037909075456 -0.574397253356047 0.06414215887183682 0.014497771113433552 0.06414215887183682 -1.1453997756154077" free_energy=-2.247582007957887 pbc="T F T"
Mo       0.03848316       0.19178619       0.17895518       1.45491990      -5.09051340       0.84151861 
Mo       1.64339576       1.61455359       0.03253581      -0.38864153       7.38930794      -1.23735623 
Mo       1.64904689       0.10609294       1.44171539      -0.16664221      -6.24658254       0.34437471 
Mo       2.74343467       1.32157598       1.29208456      -0.89963616       3.94778800       0.05146292