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=6.676783284857459 stress="-2.262236193483751 0.010439037684792849 0.0075256983088661045 0.010439037684792849 -1.4511335442935729 -0.2411197060252241 0.0075256983088661045 -0.2411197060252241 -1.0146341130974958" free_energy=6.676783284857459 pbc="T F T" Au -0.10365373 0.14120549 -0.28437083 0.33043861 -25.40094505 -5.30951023 Au 1.40490803 1.41378331 0.04683757 -0.42884653 25.49877421 4.84740451 O 1.31738487 0.18292312 1.33135749 -0.07110147 -4.49280984 0.25183144 O -0.21158777 1.71547056 1.39644257 0.16950940 4.39498068 0.21027428