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=71.00148892894353 stress="-5.60388226739026 0.42243236950560376 -0.147267280805213 0.42243236950560376 -6.38303315415533 -0.33866785939204674 -0.147267280805213 -0.33866785939204674 -5.438558808515801" free_energy=71.00148892894353 pbc="F T F" Au 0.05473499 2.63890718 0.13661615 -75.77869560 34.27789597 -60.76071661 Au 1.40480033 1.67594331 0.11041876 59.60075170 -49.43771593 -57.30627557 Au 1.26735611 2.83533445 1.24148635 59.54102814 46.44503998 65.72615290 Au 0.08611608 1.53369179 1.52598936 -43.36308424 -31.28522002 52.34083927