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=1881.2689708054838 pbc="F T T" Cf 0.16384048 0.15610282 -0.18132409 98 -2290.90896331 -1765.41963622 332.24831470 Cf 1.56865064 1.53269622 -0.11361418 98 1937.66768198 2464.58220181 -1426.51776487 Cf 1.75377227 0.15283892 1.25354470 98 1346.17381360 -1461.05527953 1716.15026641 Cf -0.26616727 1.56016899 1.39762749 98 -992.93253227 761.89271394 -621.88081623