 Ba C O
   1.0
     4.5451516200000004    0.0000000000000000   -0.0611180200000000
     0.0000000000000000    5.2831088199999998    0.0000000000000000
    -2.1553897900000001    0.0000000000000000    6.5330868200000003
 Ba C O
   2   2   6
Direct
   0.6700114800000000  0.7687992800000000  0.7709411800000000
   0.3299885200000000  0.2687992800000000  0.2290588200000000
   0.2612635200000000  0.2687995000000000  0.7588649300000000
   0.7387364800000000  0.7687995000000000  0.2411350700000000
   0.1861177500000000  0.0563495700000000  0.8242842500000001
   0.1861199200000000  0.4812497800000000  0.8242861300000000
   0.4285116700000000  0.2688008900000000  0.6374812500000000
   0.5714883300000000  0.7688008900000000  0.3625187500000000
   0.8138822500000000  0.5563495700000001  0.1757157500000000
   0.8138800800000000  0.9812497800000000  0.1757138700000000