 S Rb Au
   1.0
     6.5940185600000003    0.0000000000000000    0.0000000000000000
     0.0000000000000000    8.1265391000000005    0.0000000000000000
     0.0000000000000000    0.0000000000000000    6.5955007900000000
 S Rb Au
   4   4   4
Direct
   0.5000000000000000  0.6977048200000000  0.7500000000000000
   0.5000000000000000  0.3022951800000000  0.2500000000000000
   0.0000000000000000  0.1977048200000000  0.7500000000000000
   0.0000000000000000  0.8022951800000000  0.2500000000000000
   0.5000000000000000  0.1260282000000000  0.7500000000000000
   0.5000000000000000  0.8739718000000000  0.2500000000000000
   0.0000000000000000  0.6260281999999999  0.7500000000000000
   0.0000000000000000  0.3739718000000000  0.2500000000000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.0000000000000000  0.0000000000000000  0.5000000000000000
   0.5000000000000000  0.5000000000000000  0.0000000000000000
   0.5000000000000000  0.5000000000000000  0.5000000000000000