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=44.84241021875098 stress="-3.3318623610191866 -0.6397408189766569 0.16082110624494356 -0.6397408189766569 -5.0081822787298504 -0.6456896415968804 0.16082110624494356 -0.6456896415968804 -3.504693146162415" free_energy=44.84241021875098 pbc="F T F" Au 0.28278197 0.06210000 0.13362859 -35.78651964 -20.27190714 -34.37434197 Au 1.32702941 1.31183065 0.04852473 43.74893742 7.30837919 -34.39503115 Au 1.55473499 2.63890718 1.63661615 29.70481532 8.22235617 30.06825105 Au 0.11041876 1.26735611 1.33533445 -37.66723310 4.74117178 38.70112207