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=10204.145348816459 pbc="F T F"
Bk       0.10664015       0.16298807       0.04745362       97  -14843.58153293  -11896.86861106  -12475.57037332 
Bk       1.41927389       1.41165362       0.16920080       97    7605.25441844   29226.36831657  -21399.74575218 
Bk       1.59478509       0.09515832       1.23104684       97   12290.63256687  -22968.94459304   24846.49156897 
Bk      -0.07266223       1.09469569       1.67181405       97   -5052.30545238    5639.44488753    9028.82455652