 Ba In Br O
   1.0
     4.2503778099999998    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.2503778099999998    0.0000000000000000
     0.0000000000000000    0.0000000000000000   15.4344442399999995
 Ba In Br O
   4   2   2   6
Direct
   0.0000000000000000  0.5000000000000000  0.6589396300000000
   0.5000000000000000  0.0000000000000000  0.3410603700000000
   0.5000000000000000  0.0000000000000000  0.0928037100000000
   0.0000000000000000  0.5000000000000000  0.9071962900000000
   0.0000000000000000  0.5000000000000000  0.2075258700000000
   0.5000000000000000  0.0000000000000000  0.7924741300000000
   0.5000000000000000  0.0000000000000000  0.5754675700000000
   0.0000000000000000  0.5000000000000000  0.4245324300000000
   0.0000000000000000  0.0000000000000000  0.7694556200000000
   0.5000000000000000  0.5000000000000000  0.7694556200000000
   0.0000000000000000  0.0000000000000000  0.2305443800000000
   0.5000000000000000  0.0000000000000000  0.9278525700000000
   0.5000000000000000  0.5000000000000000  0.2305443800000000
   0.0000000000000000  0.5000000000000000  0.0721474300000000