# generated using pymatgen
data_Cs(IrO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.18559167
_cell_length_b   7.18516779
_cell_length_c   7.18514291
_cell_angle_alpha   60.00402433
_cell_angle_beta   59.99816290
_cell_angle_gamma   59.99782459
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cs(IrO3)2
_chemical_formula_sum   'Cs2 Ir4 O12'
_cell_volume   262.31304970
_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
  Cs  Cs0  1  0.50000000  0.50000000  0.50000000  1.0
  Cs  Cs1  1  0.25000000  0.25000000  0.25000000  1.0
  Ir  Ir2  1  0.37500807  0.87480320  0.87511875  1.0
  Ir  Ir3  1  0.87480320  0.37500807  0.87507097  1.0
  Ir  Ir4  1  0.87511875  0.87507097  0.37500807  1.0
  Ir  Ir5  1  0.87507097  0.87511875  0.87480320  1.0
  O  O6  1  0.94472226  0.94472226  0.55527774  1.0
  O  O7  1  0.55527774  0.55527774  0.94472226  1.0
  O  O8  1  0.94417742  0.55582258  0.94417742  1.0
  O  O9  1  0.55582258  0.94417742  0.55582258  1.0
  O  O10  1  0.80596357  0.80596357  0.19403643  1.0
  O  O11  1  0.19403643  0.19403643  0.80596357  1.0
  O  O12  1  0.55602543  0.94397457  0.94397457  1.0
  O  O13  1  0.94397457  0.55602543  0.55602543  1.0
  O  O14  1  0.80539057  0.19460943  0.80539057  1.0
  O  O15  1  0.19460943  0.80539057  0.19460943  1.0
  O  O16  1  0.19422598  0.80577402  0.80577402  1.0
  O  O17  1  0.80577402  0.19422598  0.19422598  1.0