# generated using pymatgen
data_Ba3YIr2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.95641191
_cell_length_b   5.95641191
_cell_length_c   14.72769200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999897
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3YIr2O9
_chemical_formula_sum   'Ba6 Y2 Ir4 O18'
_cell_volume   452.51687120
_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  0.00000000  0.00000000  0.25000000  1.0
  Ba  Ba1  1  0.00000000  0.00000000  0.75000000  1.0
  Ba  Ba2  1  0.33333300  0.66666700  0.59318100  1.0
  Ba  Ba3  1  0.66666700  0.33333300  0.40681900  1.0
  Ba  Ba4  1  0.66666700  0.33333300  0.09318100  1.0
  Ba  Ba5  1  0.33333300  0.66666700  0.90681900  1.0
  Y  Y6  1  0.00000000  0.00000000  0.50000000  1.0
  Y  Y7  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir8  1  0.33333300  0.66666700  0.33582600  1.0
  Ir  Ir9  1  0.66666700  0.33333300  0.66417400  1.0
  Ir  Ir10  1  0.66666700  0.33333300  0.83582600  1.0
  Ir  Ir11  1  0.33333300  0.66666700  0.16417400  1.0
  O  O12  1  0.49054700  0.50945300  0.25000000  1.0
  O  O13  1  0.49054700  0.98109500  0.25000000  1.0
  O  O14  1  0.01890500  0.50945300  0.25000000  1.0
  O  O15  1  0.50945300  0.49054700  0.75000000  1.0
  O  O16  1  0.50945300  0.01890500  0.75000000  1.0
  O  O17  1  0.98109500  0.49054700  0.75000000  1.0
  O  O18  1  0.17631600  0.82368400  0.08698700  1.0
  O  O19  1  0.17631600  0.35263300  0.08698700  1.0
  O  O20  1  0.64736700  0.82368400  0.08698700  1.0
  O  O21  1  0.82368400  0.17631600  0.91301300  1.0
  O  O22  1  0.82368400  0.64736700  0.91301300  1.0
  O  O23  1  0.35263300  0.17631600  0.91301300  1.0
  O  O24  1  0.82368400  0.17631600  0.58698700  1.0
  O  O25  1  0.82368400  0.64736700  0.58698700  1.0
  O  O26  1  0.35263300  0.17631600  0.58698700  1.0
  O  O27  1  0.17631600  0.82368400  0.41301300  1.0
  O  O28  1  0.17631600  0.35263300  0.41301300  1.0
  O  O29  1  0.64736700  0.82368400  0.41301300  1.0