# generated using pymatgen
data_Ba3CoIr2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85119207
_cell_length_b   5.85119207
_cell_length_c   14.47056500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000084
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3CoIr2O9
_chemical_formula_sum   'Ba6 Co2 Ir4 O18'
_cell_volume   429.04695673
_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  0.08784800  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.91215200  1.0
  Ba  Ba2  1  0.66666700  0.33333300  0.58784800  1.0
  Ba  Ba3  1  0.33333300  0.66666700  0.41215200  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.25000000  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.75000000  1.0
  Co  Co6  1  0.00000000  0.00000000  0.00000000  1.0
  Co  Co7  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir8  1  0.33333300  0.66666700  0.65489700  1.0
  Ir  Ir9  1  0.66666700  0.33333300  0.34510300  1.0
  Ir  Ir10  1  0.66666700  0.33333300  0.15489700  1.0
  Ir  Ir11  1  0.33333300  0.66666700  0.84510300  1.0
  O  O12  1  0.51453100  0.02906100  0.25000000  1.0
  O  O13  1  0.48546900  0.97093900  0.75000000  1.0
  O  O14  1  0.97093900  0.48546900  0.25000000  1.0
  O  O15  1  0.02906100  0.51453100  0.75000000  1.0
  O  O16  1  0.51453100  0.48546900  0.25000000  1.0
  O  O17  1  0.48546900  0.51453100  0.75000000  1.0
  O  O18  1  0.16942500  0.33885000  0.58184500  1.0
  O  O19  1  0.83057500  0.66115000  0.41815500  1.0
  O  O20  1  0.66115000  0.83057500  0.58184500  1.0
  O  O21  1  0.83057500  0.66115000  0.08184500  1.0
  O  O22  1  0.33885000  0.16942500  0.41815500  1.0
  O  O23  1  0.16942500  0.33885000  0.91815500  1.0
  O  O24  1  0.16942500  0.83057500  0.58184500  1.0
  O  O25  1  0.33885000  0.16942500  0.08184500  1.0
  O  O26  1  0.83057500  0.16942500  0.41815500  1.0
  O  O27  1  0.66115000  0.83057500  0.91815500  1.0
  O  O28  1  0.83057500  0.16942500  0.08184500  1.0
  O  O29  1  0.16942500  0.83057500  0.91815500  1.0