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=-2.2798288383675684 stress="-42.409398860528654 10.74764226757866 -3.7297083713708155 10.74764226757866 -47.2572837652456 2.453351328220677 -3.7297083713708155 2.453351328220677 -37.72760512641223" pbc="F F F"
Mo      -0.12320595      -0.04105180       0.20259391     -14.79915427      -9.78461159      -9.46611959 
Mo       1.56504129       1.20865944      -0.13449789      10.37149705       8.79687666     -13.12861271 
Mo       1.28802619       0.22277084       1.68584377      21.31585687     -23.45351365      17.16882656 
Mo       0.18362810       1.69581920       1.64685009     -16.88819965      24.44124858       5.42590574