 Au Br
   1.0
     4.1109326399999997    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.1109326399999997    0.0000000000000000
     0.0000000000000000    0.0000000000000000   12.8716732799999996
 Au Br
   4   4
Direct
   0.2500000000000000  0.7500000000000000  0.7500000000000000
   0.7500000000000000  0.7500000000000000  0.2500000000000000
   0.2500000000000000  0.2500000000000000  0.2500000000000000
   0.7500000000000000  0.2500000000000000  0.7500000000000000
   0.5000000000000000  0.0000000000000000  0.9050522300000000
   0.5000000000000000  0.0000000000000000  0.4050522300000000
   0.0000000000000000  0.5000000000000000  0.0949477700000000
   0.0000000000000000  0.5000000000000000  0.5949477700000000