Ca 
 1.0000000000000000
     3.8611218532907481    0.0000000000000000   -0.0000000000000000
    -1.9305609266453740    3.3438296120570405   -0.0000000000000000
     0.0000000000000000    0.0000000000000000    3.6532130802928826
 Ca 
   1
Selective dynamics
Cartesian
  0.0000000000000000  0.0000000000000000  0.0000000000000000   T   T   T