 O Si Ba
   1.0
     6.5149468500000003    0.0000000000000000    0.0000000000000000
    -3.2574734300000001    5.6421094800000002    0.0000000000000000
     0.0000000000000000    0.0000000000000000    9.4241776599999998
 O Si Ba
  18   8   2
Direct
   0.6607767000000000  0.1046746900000000  0.3934725000000000
   0.6607767000000000  0.5561020000000000  0.6065275000000000
   0.4438980000000000  0.3392233000000000  0.3934725000000000
   0.8953253100000000  0.5561020000000000  0.3934725000000000
   0.4438980000000000  0.3392233000000000  0.1065275000000000
   0.8953253100000000  0.5561020000000000  0.1065275000000000
   0.6607767000000000  0.1046746900000000  0.1065275000000000
   0.4438980000000000  0.1046746900000000  0.8934725000000000
   0.8953253100000000  0.3392233000000000  0.8934725000000000
   0.8953253100000000  0.3392233000000000  0.6065275000000000
   0.1888916300000000  0.2662292700000000  0.7500000000000000
   0.7337707300000000  0.9226623500000000  0.7500000000000000
   0.0773376500000000  0.8111083700000000  0.7500000000000000
   0.1888916300000000  0.9226623500000000  0.2500000000000000
   0.0773376500000000  0.2662292700000000  0.2500000000000000
   0.7337707300000000  0.8111083700000000  0.2500000000000000
   0.6607767000000000  0.5561020000000000  0.8934725000000000
   0.4438980000000000  0.1046746900000000  0.6065275000000000
   0.3014708400000000  0.2126449600000000  0.2500000000000000
   0.9111741200000000  0.6985291600000000  0.2500000000000000
   0.7873550400000000  0.0888258800000000  0.2500000000000000
   0.9111741200000000  0.2126449600000000  0.7500000000000000
   0.3014708400000000  0.0888258800000000  0.7500000000000000
   0.7873550400000000  0.6985291600000000  0.7500000000000000
   0.6666666700000000  0.3333333300000000  0.5000000000000000
   0.6666666700000000  0.3333333300000000  0.0000000000000000
   0.3333333300000000  0.6666666700000000  0.5000000000000000
   0.3333333300000000  0.6666666700000000  0.0000000000000000