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:forces:R:3 energy=1368.4530864526603 stress="-6189.775356279566 -28.915996376640237 337.5559710364937 -28.915996376640237 -4976.232927027248 1059.2957710946807 337.5559710364937 1059.2957710946807 -6129.3436322643065" pbc="F F F" Cf 0.03006230 0.16347439 0.05407094 -2326.20218699 -690.95330788 -1937.91048074 Cf 1.61927103 1.51275421 0.26660383 2586.41193763 2029.45183466 -2665.35228096 Cf 1.46563619 -0.13464291 1.37841332 1743.52783558 -2379.82523519 2389.50944163 Cf 0.24143534 1.63128218 1.64923062 -2003.73758622 1041.32670841 2213.75332007