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=61.384248765844475 stress="-2.9454178312825885 -0.012638224279162062 -0.007005420734742965 -0.012638224279162062 -2.90503245466812 0.027976925729184324 -0.007005420734742965 0.027976925729184324 -1.0993853394271444" free_energy=61.384248765844475 pbc="T T F" Rb 0.21804360 -0.29134056 0.22277084 0.35924597 1.84121127 -10.49798584 Rb 1.68584377 1.68362810 0.19581920 -0.63647007 -1.21863956 -11.00096456 Rb 1.68533325 0.22734064 1.67626233 -0.97663940 0.01090839 11.39188239 Rb -0.14597521 1.62848498 1.49207130 1.25386350 -0.63348010 10.10706801