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=5236.221672675494 pbc="T T F" Xe 0.20996341 0.10662489 0.15300231 54 -13317.73721732 871.47898472 -11701.27716530 Xe 1.53848316 1.49028240 -0.08147842 54 2188.72630778 386.20548645 -3286.38021530 Xe 1.45789336 -0.11174318 1.27041603 54 15061.66746422 2818.73742120 12018.37883814 Xe 0.19178619 1.67895518 1.79140871 54 -3932.65655468 -4076.42189237 2969.27854247