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=5.202516551206333 pbc="F T F" Xe -0.18909945 0.29612785 -0.05828890 54 -4.21828054 -7.90960811 -10.43037082 Xe 1.69966297 1.55950682 -0.01736651 54 6.73587902 0.00659970 -7.27908256 Xe 1.53504143 0.01712679 1.59814793 54 8.16243562 3.33036233 4.60702752 Xe 0.20075533 1.58909838 1.29877203 54 -10.68003411 4.57264609 13.10242586