O Ti 
 1.0000000000000000
     4.8234000000000004    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.8234000000000004    0.0000000000000000
     0.0000000000000000    0.0000000000000000    4.8234000000000004
 O   Ti 
   8   4
Cartesian
  1.6280670907440000  1.6280670907440000  1.6280670907440000
  0.7836329092560000  3.1953329092559999  4.0397670907440002
  3.1953329092559999  4.0397670907440002  0.7836329092560000
  4.0397670907440002  0.7836329092560000  3.1953329092559999
  3.1953329092559999  3.1953329092559999  3.1953329092559999
  4.0397670907440002  1.6280670907440000  0.7836329092560000
  1.6280670907440000  0.7836329092560000  4.0397670907440002
  0.7836329092560000  4.0397670907440002  1.6280670907440000
  0.0000000000000000  0.0000000000000000  0.0000000000000000
  2.4117000000000002  0.0000000000000000  2.4117000000000002
  0.0000000000000000  2.4117000000000002  2.4117000000000002
  2.4117000000000002  2.4117000000000002  0.0000000000000000