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=62.93495008416202 stress="-2.929284975635263 0.010172804451020144 -0.00827938303558561 0.010172804451020144 -1.0937570974089237 0.00023746875793222516 -0.00827938303558561 0.00023746875793222516 -2.971125594444432" free_energy=62.93495008416202 pbc="T F T" Rb -0.04210664 0.19178619 0.15463060 1.60714205 -10.63407383 -1.88402102 Rb 1.79140871 1.61455359 0.09583508 -2.00316576 12.55653980 -1.62990192 Rb 1.64904689 0.10609294 1.40349439 -1.75070290 -11.38509388 1.36360159 Rb -0.19401975 1.32157598 1.29208456 2.14672661 9.46262791 2.15032135