 Ca As Rb
   1.0
     5.1028773000000003    0.0000000000000000    0.0000000000000000
     0.0000000000000000    5.1028773000000003    0.0000000000000000
     0.0000000000000000    0.0000000000000000    7.8583527399999999
 Ca As Rb
   2   2   2
Direct
   0.5000000000000000  0.5000000000000000  0.0000000000000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.5000000000000000  0.0000000000000000  0.1853790800000000
   0.0000000000000000  0.5000000000000000  0.8146209200000000
   0.0000000000000000  0.5000000000000000  0.3723510300000000
   0.5000000000000000  0.0000000000000000  0.6276489700000000