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=-2.2798264684625673 stress="-42.40957139132733 10.748470942026902 -3.7301815072047937 10.748470942026902 -47.25687811626682 2.452583410847069 -3.7301815072047937 2.452583410847069 -37.726515864163325" pbc="F F F" Mo -0.12320595 -0.04105180 0.20259391 -14.79907550 -9.78432461 -9.46630038 Mo 1.56504129 1.20865944 -0.13449789 10.37118016 8.79621629 -13.12786679 Mo 1.28802619 0.22277084 1.68584377 21.31643136 -23.45335825 17.16827173 Mo 0.18362810 1.69581920 1.64685009 -16.88853601 24.44146657 5.42589544