Ca 
 1.0000000000000000
     4.6106109978666909   -0.0000000000000000   -0.0000000000000000
    -0.0000000000000000    4.6106109978666909    0.0000000000000000
    -0.0000000000000000    0.0000000000000000    3.9602205110511393
 Ca 
   2
Selective dynamics
Cartesian
  0.0000000000000000  0.0000000000000000  0.0000000000000000   T   T   T
  2.3053054989333441  2.3053054989333450  1.9801102555255694   T   T   T