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=75.34410216917432 stress="-3.45010349765699 0.010714553902575044 -0.00857714381598475 0.010714553902575044 -1.2126944703356641 0.00041029939001744096 -0.00857714381598475 0.00041029939001744096 -3.4937032590880057" free_energy=75.34410216917432 pbc="T F T" Cs -0.04210664 0.19178619 0.15463060 1.68496373 -11.76695178 -1.97130638 Cs 1.79140871 1.61455359 0.09583508 -2.09748087 13.95987888 -1.70591835 Cs 1.64904689 0.10609294 1.40349439 -1.83373748 -12.63582971 1.43024951 Cs -0.19401975 1.32157598 1.29208456 2.24625461 10.44290261 2.24697522