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=118046.81569603672 stress="-17056.39272960752 -4078.159954229089 5157.622440586509 -4078.159954229089 -18203.567322355866 -3461.4569065855676 5157.622440586509 -3461.4569065855676 -17606.8115135472" pbc="F T T" Rb 0.15559783 0.07750753 0.08289838 -97523.20995826 -48045.52754881 -61265.98948511 Rb 1.55210464 1.39703577 0.26712008 218118.48097164 -38192.10135878 -230304.76191901 Rb 1.52545713 -0.20267930 1.43767987 137700.15362263 122685.35860664 116987.73232949 Rb 0.28224032 1.46728713 1.45258323 -258295.42463601 -36447.72969906 174583.01907463