 B O As Ba
   1.0
     5.5150992299999997    0.0000000000000000    0.0000000000000000
    -2.7575496199999998    4.7762160400000004    0.0000000000000000
     0.0000000000000000    0.0000000000000000   13.8346267800000007
 B O As Ba
   2   6   2   6
Direct
   0.6666666700000000  0.3333333300000000  0.7500000000000000
   0.3333333300000000  0.6666666700000000  0.2500000000000000
   0.0413718900000000  0.5206859400000000  0.2500000000000000
   0.5206859400000000  0.4793140600000000  0.7500000000000000
   0.9586281100000000  0.4793140600000000  0.7500000000000000
   0.4793140600000000  0.9586281100000000  0.2500000000000000
   0.4793140600000000  0.5206859400000000  0.2500000000000000
   0.5206859400000000  0.0413718900000000  0.7500000000000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.0000000000000000  0.0000000000000000  0.5000000000000000
   0.3333333300000000  0.6666666700000000  0.6010788100000000
   0.0000000000000000  0.0000000000000000  0.7500000000000000
   0.0000000000000000  0.0000000000000000  0.2500000000000000
   0.6666666700000000  0.3333333300000000  0.1010788100000000
   0.6666666700000000  0.3333333300000000  0.3989211900000000
   0.3333333300000000  0.6666666700000000  0.8989211900000000