 S Ba Hf
   1.0
     4.8976717599999997    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.8976717599999997    0.0000000000000000
     0.0000000000000000    0.0000000000000000   15.6654933399999994
 S Ba Hf
   8   4   2
Direct
   0.5000000000000000  0.0000000000000000  0.0000000000000000
   0.0000000000000000  0.5000000000000000  0.0000000000000000
   0.5000000000000000  0.5000000000000000  0.3377150500000000
   0.0000000000000000  0.0000000000000000  0.1622849500000000
   0.0000000000000000  0.5000000000000000  0.5000000000000000
   0.5000000000000000  0.0000000000000000  0.5000000000000000
   0.0000000000000000  0.0000000000000000  0.8377150500000000
   0.5000000000000000  0.5000000000000000  0.6622849500000000
   0.0000000000000000  0.0000000000000000  0.3581648300000000
   0.5000000000000000  0.5000000000000000  0.1418351700000000
   0.5000000000000000  0.5000000000000000  0.8581648300000000
   0.0000000000000000  0.0000000000000000  0.6418351700000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.5000000000000000  0.5000000000000000  0.5000000000000000