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=9216.735701562846 pbc="F F T"
Pa      -0.27293218       0.17683275       0.22742953       91   -4770.53566460  -21493.61220665  -11101.59490167 
Pa       1.59341127       1.62680775       0.23164874       91    7383.26193093   10507.08086246   -2028.96584253 
Pa       1.74939942      -0.04235554       1.74568306       91    3286.37719438   -9544.13336823    -432.68235183 
Pa      -0.25451736       1.75312691       1.51853895       91   -5899.10346072   20530.66471242   13563.24309603