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=21.49295562288048 stress="-14.535760816518508 0.10666149433583216 1.3482986316644787 0.10666149433583216 -12.095394105076897 0.5371104815021521 1.3482986316644787 0.5371104815021521 -12.255489946625417" pbc="F F F" Rb 0.19178619 0.17895518 0.29140871 -4.46867211 -4.70892678 -5.93985471 Rb 1.61455359 1.53253581 0.14904689 4.81190491 4.77498563 -3.84785297 Rb 1.28091226 0.10609294 1.46603997 5.12370608 -4.69570209 5.35784487 Rb -0.19401975 1.32157598 1.51361598 -5.46693889 4.62964323 4.42986281