 O Br Bi
   1.0
     3.9051302400000001    0.0000000000000000    0.0000000000000000
     0.0000000000000000    3.9051302400000001    0.0000000000000000
     0.0000000000000000    0.0000000000000000    8.2637684399999998
 O Br Bi
   2   2   2
Direct
   0.5000000000000000  0.5000000000000000  0.0000000000000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.0000000000000000  0.5000000000000000  0.6617886200000000
   0.5000000000000000  0.0000000000000000  0.3382113800000000
   0.5000000000000000  0.0000000000000000  0.8479588400000000
   0.0000000000000000  0.5000000000000000  0.1520411600000000