data_[H8Ir4Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  H  2.2000  0.2500  0.0000
  Ir  2.2000  1.3500  0.7650
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.1888]
_cell_length_b [11.9963]
_cell_length_c [6.1032]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.8376]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [H2IrCl6]
_chemical_formula_sum '[H8 Ir4 Cl24]'
_cell_volume [1033.4600]
_cell_formula_units_Z [4]
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
[
  H  H0  8  0.1298  0.4764  0.2808  1.0
  Ir  Ir1  4  0.0000  0.0759  0.7500  1.0
  Cl  Cl2  8  0.0898  0.0692  0.0994  1.0
  Cl  Cl3  8  0.0994  0.2052  0.6268  1.0
  Cl  Cl4  8  0.1334  0.4130  0.1086  1.0
]