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=117.0919395376982 stress="-9.790988150131923 0.3633084070753164 0.08255757012676589 0.3633084070753164 -6.797195129381186 0.055879318559330794 0.08255757012676589 0.055879318559330794 -6.982099110230574" free_energy=117.0919395376982 pbc="T F F" Pb -0.14801295 0.06329927 0.09073906 32.52739919 -81.59057744 -65.71292433 Pb 1.77219963 1.43381326 0.13132919 -38.01828178 72.55983683 -62.57599265 Pb 1.75978669 0.18365717 1.70288723 -31.94348741 -65.59011002 66.41862287 Pb 0.08343331 1.29585403 1.44809454 37.43437001 74.62085063 61.87029412