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=51.699226753264725 pbc="F F T" Rn 0.26008070 0.07941505 -0.04891933 86 -138.01673014 -184.47441631 -36.58851052 Rn 1.32110523 1.33100236 0.11204210 86 168.86968153 171.51014768 -24.67307393 Rn 1.63484852 -0.01117087 1.50686044 86 26.41719702 -23.47613116 4.83055481 Rn -0.02429044 1.29510036 1.32780233 86 -57.27014841 36.44039979 56.43102963