# generated using pymatgen
data_Ba3Ti2IrO9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.74490773
_cell_length_b   5.74490789
_cell_length_c   14.15556192
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999903
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3Ti2IrO9
_chemical_formula_sum   'Ba6 Ti4 Ir2 O18'
_cell_volume   404.59813602
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ba  Ba0  1  0.33333300  0.66666700  0.40760618  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.90760618  1.0
  Ba  Ba2  1  0.66666700  0.33333300  0.59762788  1.0
  Ba  Ba3  1  0.33333300  0.66666700  0.09762788  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.75233684  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.25233684  1.0
  Ti  Ti6  1  0.66666700  0.33333300  0.35145170  1.0
  Ti  Ti7  1  0.33333300  0.66666700  0.85145170  1.0
  Ti  Ti8  1  0.00000000  0.00000000  0.50426776  1.0
  Ti  Ti9  1  0.00000000  0.00000000  0.00426776  1.0
  Ir  Ir10  1  0.33333300  0.66666700  0.65717831  1.0
  Ir  Ir11  1  0.66666700  0.33333300  0.15717831  1.0
  O  O12  1  0.83332381  0.16667619  0.41722732  1.0
  O  O13  1  0.83332381  0.66664662  0.41722732  1.0
  O  O14  1  0.33335338  0.16667619  0.41722732  1.0
  O  O15  1  0.66664662  0.83332381  0.91722732  1.0
  O  O16  1  0.16342962  0.32686024  0.57626483  1.0
  O  O17  1  0.16667619  0.83332381  0.91722732  1.0
  O  O18  1  0.16667619  0.33335338  0.91722732  1.0
  O  O19  1  0.83657038  0.16342962  0.07626483  1.0
  O  O20  1  0.32686024  0.16342962  0.07626483  1.0
  O  O21  1  0.67313976  0.83657038  0.57626483  1.0
  O  O22  1  0.16342962  0.83657038  0.57626483  1.0
  O  O23  1  0.83657038  0.67313976  0.07626483  1.0
  O  O24  1  0.51513033  0.03026265  0.24968464  1.0
  O  O25  1  0.48486967  0.51513033  0.74968464  1.0
  O  O26  1  0.03026265  0.51513033  0.74968464  1.0
  O  O27  1  0.96973735  0.48486967  0.24968464  1.0
  O  O28  1  0.51513033  0.48486967  0.24968464  1.0
  O  O29  1  0.48486967  0.96973735  0.74968464  1.0