 Ba Ta Cd O
   1.0
     5.8747648999999997    0.0000000000000000    0.0000000000000000
    -2.9373824499999999    5.0876956399999997    0.0000000000000000
     0.0000000000000000    0.0000000000000000    7.2633299800000000
 Ba Ta Cd O
   3   2   1   9
Direct
   0.6666666700000000  0.3333333300000000  0.3379396800000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.3333333300000000  0.6666666700000000  0.6620603199999999
   0.3333333300000000  0.6666666700000000  0.1670844700000000
   0.6666666700000000  0.3333333300000000  0.8329155300000000
   0.0000000000000000  0.0000000000000000  0.5000000000000000
   0.3524556800000000  0.1762278400000000  0.6863638000000001
   0.8237721600000000  0.6475443200000000  0.6863638000000001
   0.1762278400000000  0.3524556800000000  0.3136362000000000
   0.0000000000000000  0.5000000000000000  0.0000000000000000
   0.1762278400000000  0.8237721600000000  0.3136362000000000
   0.6475443200000000  0.8237721600000000  0.3136362000000000
   0.8237721600000000  0.1762278400000000  0.6863638000000001
   0.5000000000000000  0.0000000000000000  0.0000000000000000
   0.5000000000000000  0.5000000000000000  0.0000000000000000