 O Cl Ba
   1.0
     9.9483485199999997    0.0000000000000000    0.0000000000000000
    -4.9741742599999998    8.6155225400000006    0.0000000000000000
     0.0000000000000000    0.0000000000000000    7.5089499999999996
 O Cl Ba
   2  12   8
Direct
   0.6666666700000000  0.3333333300000000  0.4030638500000000
   0.3333333300000000  0.6666666700000000  0.9030638500000000
   0.5292104200000001  0.4707895800000000  0.7890535900000000
   0.4707895800000000  0.9415791800000000  0.2890535900000000
   0.0584208200000000  0.5292104200000001  0.2890535900000000
   0.9415791800000000  0.4707895800000000  0.7890535900000000
   0.5292104200000001  0.0584208200000000  0.7890535900000000
   0.4707895800000000  0.5292104200000001  0.2890535900000000
   0.7067395400000001  0.8533697700000000  0.6061085100000000
   0.8533697700000000  0.1466302300000000  0.1061085100000000
   0.8533697700000000  0.7067395400000001  0.1061085100000000
   0.1466302300000000  0.2932604600000000  0.6061085100000000
   0.1466302300000000  0.8533697700000000  0.6061085100000000
   0.2932604600000000  0.1466302300000000  0.1061085100000000
   0.6666666700000000  0.3333333300000000  0.0681372600000000
   0.3333333300000000  0.6666666700000000  0.5681372600000000
   0.3902535500000000  0.1951267800000000  0.5060708700000001
   0.1951267800000000  0.8048732199999999  0.0060708700000000
   0.1951267800000000  0.3902535500000000  0.0060708700000000
   0.8048732199999999  0.6097464500000001  0.5060708700000001
   0.8048732199999999  0.1951267800000000  0.5060708700000001
   0.6097464500000001  0.8048732199999999  0.0060708700000000