made by tetr; --> species: C O  Ca -> Sp
   1.00000000000000     
     0.0000000000000000   -2.8809860721086000    5.6868747350646203
     2.4950070816142298    1.4404930360543000    5.6868747350646203
    -2.4950070816142298    1.4404930360543000    5.6868747350646203
   C    O    Ca
     2     6     2
Selective dynamics
Direct
  0.2499999999999716  0.2499999999999716  0.2499999999999716   T   T   T
  0.7500000000000284  0.7500000000000284  0.7500000000000284   T   T   T
  0.9903035981587464  0.5096964018412536  0.2499999999999147   T   T   T
  0.2500000044870916  0.9903035959152716  0.5096963995975515   T   T   T
  0.5096963973540768  0.2500000022435884 -0.0096963995977504   T   T   T
  0.0096964018412536  0.4903035981587464  0.7500000000000853   T   T   T
  0.7499999955129084  0.0096964040847283  0.4903036004024485   T   T   T
  0.4903036026459232  0.7499999977564116  1.0096963995977506   T   T   T
  0.0000000000000000  0.0000000000000000  0.0000000000000000   T   T   T
  0.5000000000000071  0.5000000000000071  0.5000000000000071   T   T   T
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
