O Ti 
 1.0000000000000000
     4.4481000000000002    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.4481000000000002    0.0000000000000000
     0.0000000000000000    0.0000000000000000    4.4481000000000002
 O   Ti 
   8   4
Cartesian
  1.1120250000000000  1.1120250000000000  1.1120250000000000
  3.3360750000000001  3.3360750000000001  1.1120250000000000
  3.3360750000000001  1.1120250000000000  3.3360750000000001
  1.1120250000000000  3.3360750000000001  3.3360750000000001
  1.1120250000000000  1.1120250000000000  3.3360750000000001
  3.3360750000000001  3.3360750000000001  3.3360750000000001
  1.1120250000000000  3.3360750000000001  1.1120250000000000
  3.3360750000000001  1.1120250000000000  1.1120250000000000
  0.0000000000000000  0.0000000000000000  0.0000000000000000
  0.0000000000000000  2.2240500000000001  2.2240500000000001
  2.2240500000000001  0.0000000000000000  2.2240500000000001
  2.2240500000000001  2.2240500000000001  0.0000000000000000