 Ba Sc O
   1.0
     5.9474072800000002    0.0000000000000000    0.0000000000000000
     0.0000000000000000   11.7718365299999999    0.0000000000000000
     0.0000000000000000    0.0000000000000000    3.9817730500000001
 Ba Sc O
   4   4  10
Direct
   0.2334551500000000  0.8729325700000000  0.5000000000000000
   0.2665448500000000  0.3729325700000000  0.5000000000000000
   0.7334551499999999  0.6270674300000000  0.5000000000000000
   0.7665448500000001  0.1270674300000000  0.5000000000000000
   0.2626400000000000  0.6320050300000000  0.0000000000000000
   0.2373600000000000  0.1320050300000000  0.0000000000000000
   0.7626400000000000  0.8679949700000000  0.0000000000000000
   0.7373600000000000  0.3679949700000000  0.0000000000000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.0199553100000000  0.2574626100000000  0.0000000000000000
   0.1912321900000000  0.5984656800000000  0.5000000000000000
   0.3087678100000000  0.0984656800000000  0.5000000000000000
   0.4800446900000000  0.7574626100000000  0.0000000000000000
   0.5000000000000000  0.5000000000000000  0.0000000000000000
   0.5199553099999998  0.2425373900000000  0.0000000000000000
   0.6912321900000000  0.9015343200000000  0.5000000000000000
   0.8087678100000000  0.4015343200000000  0.5000000000000000
   0.9800446900000001  0.7425373900000001  0.0000000000000000