Ca 
 1.0000000000000000
     5.5804867016527879    0.0000000000000000    0.0000000000000000
     0.0000000000000000    5.5804867016527879    0.0000000000000000
     0.0000000000000000    0.0000000000000000    5.5804867016527879
 Ca 
   4
Selective dynamics
Cartesian
  0.0000000000000000  0.0000000000000000  0.0000000000000000   T   T   T
  0.0000000000000000  2.7902433508263940  2.7902433508263940   T   T   T
  2.7902433508263940  0.0000000000000000  2.7902433508263940   T   T   T
  2.7902433508263940  2.7902433508263940  0.0000000000000000   T   T   T