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=132.0364982463365 stress="-12.13172430202773 0.9160661225358205 4.254891089302007 0.9160661225358205 -9.932047339863662 2.5171610313141133 4.254891089302007 2.5171610313141133 -15.80301817522441" pbc="F F T" Au 0.29874826 0.05835534 -0.25354363 -124.86392501 -96.19355479 77.83443804 Au 1.48193431 1.42001865 0.20070203 113.65571152 95.73147766 -66.98894793 Au 1.20342959 0.28187239 1.51001192 177.25716517 -125.17684505 -34.27227938 Au 0.10170120 1.37793365 1.21904386 -166.04895167 125.63892217 23.42678927