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=665.7284558686192 stress="-43.279928528141255 -1.8374654306272178 -0.3716848070298736 -1.8374654306272178 -48.868848606437496 -0.40281935146177605 -0.3716848070298736 -0.40281935146177605 -24.94449444400858" free_energy=665.7284558686192 pbc="T T F" Rb 2.71709627 0.18333836 0.01888536 102.70452202 35.78854660 -229.37330071 Rb 1.74473802 1.73393203 0.21901898 -116.93305214 -39.61280282 -199.87020190 Rb 1.28643470 0.10565368 1.76723240 62.22499721 71.75936042 222.01329774 Rb 0.12123991 1.79720586 1.58885849 -47.99646708 -67.93510420 207.23020488