made by tetr; --> species: Ca C  O -> Species: Ca  C  O
   1.00000000000000
   0.000000000000000 -2.88098607210860  5.68687473506462
   2.49500708161423  1.44049303605430  5.68687473506462
  -2.49500708161423  1.44049303605430  5.68687473506462
Ca  C  O
   2  2  6
Selective dynamics
Cartesian
  0.000000000000   0.000000000000   0.000000000000   T T T
  0.000000000000   0.000000000000   8.530312102597   T T T
 
  0.000000000000   0.000000000000   4.265156051298   T T T
  0.000000000000   0.000000000000  -4.265156051298   T T T
 
  0.623751770404   1.080369777041   4.265156051298   T T T
 -1.247503540807  -0.000000019391   4.265156051298   T T T
  0.623751770404  -1.080369757650   4.265156051298   T T T
 -0.623751770404  -1.080369777041  -4.265156051298   T T T
  1.247503540807   0.000000019391  -4.265156051298   T T T
 -0.623751770404   1.080369757650  -4.265156051298   T T T
 
