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=40.70791144829234 stress="-2.064529500417746 0.0015600337726223948 -0.0070161477407634275 0.0015600337726223948 -0.7533867905121556 0.0723088845597618 -0.0070161477407634275 0.0723088845597618 -0.7383085305562676" pbc="T F F" Rb 0.21545919 0.09073906 0.27219963 -1.25187440 -8.18767969 -7.98817542 Rb 1.25564823 1.63132919 0.25978669 1.47365772 8.26001537 -7.09741052 Rb 1.22592512 0.18365717 1.70288723 1.83883727 -6.92621804 8.27012284 Rb 0.08343331 1.29585403 1.44809454 -2.06062059 6.85388236 6.81546309