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:Z:I:1:forces:R:3 energy=85.75607856544606 pbc="T F F" Rn 0.12176270 0.09209813 0.02230494 86 -68.69064943 -40.23495457 -69.13427904 Rn 1.14529446 1.64163425 0.20303071 86 45.03201557 71.99947298 -63.75323145 Rn 1.33038481 0.12872596 1.32697414 86 335.45873651 -319.76408401 -37.08515057 Rn 0.28047442 1.20352854 1.73390714 86 -311.80010265 287.99956560 169.97266106