Ca  H  O 
 1.0000000000000000
     2.8142216367965611    0.0000000000000001   -0.0000000000000000
    -1.4071108183982806    2.4371874293456415    0.0000000000000000
    -0.0000000000000000   -0.0000000000000000    3.8206988334295477
 Ca  H   O  
   1   2   2
Selective dynamics
Cartesian
  0.0000000000000000  0.0000000000000000  0.0000000000000000   T   T   T
 -0.0000000000000024  1.6247916195637619  1.1034822140099076   T   T   T
  1.4071108183982806  0.8123958097818811  2.7172166194196397   T   T   T
 -0.0000000000000024  1.6247916195637619  2.0604159639595516   T   T   T
  1.4071108183982806  0.8123958097818811  1.7602828694699990   T   T   T