unknown system                          
           1
     7.166741    0.000000    0.000000
     0.000000   10.041358    0.000000
     0.000000    0.000000    7.058186
   Ba   Zr   S 
     4     4    12
Direct configuration=     1
   0.04719448  0.25000000  0.00957840
   0.54719448  0.25000000  0.49042160
   0.95280552  0.75000000  0.99042160
   0.45280552  0.75000000  0.50957840
   0.00000000  0.00000000  0.50000000
   0.50000000  0.50000000  0.00000000
   0.00000000  0.50000000  0.50000000
   0.50000000  0.00000000  0.00000000
   0.21323393  0.53264669  0.78675555
   0.71323393  0.96735331  0.71324445
   0.78676607  0.03264669  0.21324445
   0.28676607  0.46735331  0.28675555
   0.78676607  0.46735331  0.21324445
   0.28676607  0.03264669  0.28675555
   0.21323393  0.96735331  0.78675555
   0.71323393  0.53264669  0.71324445
   0.99397466  0.25000000  0.56152773
   0.49397466  0.25000000  0.93847227
   0.00602534  0.75000000  0.43847227
   0.50602534  0.75000000  0.06152773