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=31.45531785651861 stress="-3.1656331640533164 0.09891554562972968 0.2877809478817016 0.09891554562972968 -3.9016269066838922 1.065304397262649 0.2877809478817016 1.065304397262649 -4.194342010207075" free_energy=31.45531785651861 pbc="F F T" Au 0.05835534 0.20070203 2.70342959 -33.27019702 -35.22058199 11.74476526 Au 1.40085166 1.49793547 0.28187239 32.20300882 39.30751298 -15.51296291 Au 1.51001192 0.10170120 1.37793365 28.02907034 -36.89143240 8.79466939 Au 0.00082602 1.74624097 1.64302402 -26.96188214 32.80450142 -5.02647174