data_[K4Rb2Ir2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Rb  0.8200  2.3500  1.6600
  Ir  2.2000  1.3500  0.7650
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [7.0551]
_cell_length_b [10.7824]
_cell_length_c [8.7173]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [K2RbIrCl6]
_chemical_formula_sum '[K4 Rb2 Ir2 Cl12]'
_cell_volume [663.1313]
_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
[
  K  K0  4  0.0000  0.3026  0.1645  1.0
  Rb  Rb1  2  0.0000  0.5000  0.6742  1.0
  Ir  Ir2  2  0.0000  0.0000  0.8175  1.0
  Cl  Cl3  4  0.0000  0.2202  0.8159  1.0
  Cl  Cl4  4  0.2327  0.0000  0.0149  1.0
  Cl  Cl5  4  0.2402  0.0000  0.6276  1.0
]