Ba Ti O 
 1.0000000000000000
     4.0199999999999996    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.0199999999999996    0.0000000000000000
     0.0000000000000000    0.0000000000000000    4.0199999999999996
 Ba  Ti  O  
   1   1   3
Direct
 -0.0000000000000000 -0.0000000000000000  0.0001709915172650
  0.5000000000000000  0.5000000000000000  0.5280252524897231
  0.5000000000000000  0.5000000000000000 -0.0447761194029851
  0.5000000000000000 -0.0000000000000000  0.4797312565395918
 -0.0000000000000000  0.5000000000000000  0.4797312565395918
