Al Ca  O 
 1.0000000000000000
     7.8444115247393515    0.0000000000000000   -0.0000000000000000
     0.0000000000000000    7.8444115247393515   -0.0000000000000000
     0.0000000000000000   -0.0000000000000000    7.8444115247393515
 Al  Ca  O  
   6   9  18
Selective dynamics
Cartesian
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