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:Z:I:1:forces:R:3 energy=161.84761142769398 pbc="F T F" Hg 0.25226748 -0.03568003 0.04396501 80 -78.92944593 23.88431871 -98.23017152 Hg 1.57236142 1.70379337 0.23854596 80 107.83231879 -46.46591066 -93.71633029 Hg 1.26922180 -0.21770305 1.52031036 80 86.61401669 65.51659117 120.82869083 Hg 0.18745344 1.52015752 1.37970777 80 -115.51688956 -42.93499922 71.11781098