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=53.81971028578133 stress="-5.816246325659577 0.317199364163461 -0.5403152619981314 0.317199364163461 -6.5872406968333275 -0.04072686400153162 -0.5403152619981314 -0.04072686400153162 -6.644646888119025" free_energy=53.81971028578133 pbc="T T T" Au 2.85540510 0.11115480 0.11044915 16.12284874 -21.59305529 -6.49941001 Au 1.70960170 1.31143450 2.83833517 -33.85255009 13.15538162 10.69326337 Au 1.28829595 2.83509776 1.64041416 -4.88731517 -1.30438830 -14.71635134 Au 2.77812781 1.39558290 1.32834452 22.61701652 9.74206197 10.52249798