 H Ca Rb
   1.0
     4.4144578900000004    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.4144578900000004    0.0000000000000000
     0.0000000000000000    0.0000000000000000   14.5347734699999993
 H Ca Rb
   8   2   4
Direct
   0.5000000000000000  0.0000000000000000  0.5000000000000000
   0.0000000000000000  0.5000000000000000  0.5000000000000000
   0.0000000000000000  0.0000000000000000  0.1567407100000000
   0.5000000000000000  0.5000000000000000  0.3432592900000000
   0.0000000000000000  0.5000000000000000  0.0000000000000000
   0.5000000000000000  0.0000000000000000  0.0000000000000000
   0.5000000000000000  0.5000000000000000  0.6567407100000000
   0.0000000000000000  0.0000000000000000  0.8432592900000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.5000000000000000  0.5000000000000000  0.5000000000000000
   0.0000000000000000  0.0000000000000000  0.3519082400000000
   0.5000000000000000  0.5000000000000000  0.1480917600000000
   0.5000000000000000  0.5000000000000000  0.8519082400000000
   0.0000000000000000  0.0000000000000000  0.6480917600000000