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=59.1273023963483 stress="-4.386492295079071 0.26013197905954444 -0.3408920084985521 0.26013197905954444 -5.671774974851955 0.00912596537934879 -0.3408920084985521 0.00912596537934879 -5.522968464827652" free_energy=59.1273023963483 pbc="F T T" Au 0.18365717 0.20288723 0.08343331 -44.19334412 -27.79255871 -22.89727735 Au 1.29585403 1.44809454 0.22094491 44.95849294 23.08126646 -31.30792780 Au 1.73171545 0.18190327 1.32183498 45.04995532 -21.60475112 27.95476008 Au 0.21219253 1.42485375 1.41211116 -45.81510414 26.31604337 26.25044507