data_[Ag6Ir2I4Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Ir  2.2000  1.3500  0.7650
  I  2.6600  1.4000  1.2733
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.1236]
_cell_length_b [7.5968]
_cell_length_c [6.0397]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.7906]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ag3Ir(ICl3)2]
_chemical_formula_sum '[Ag6 Ir2 I4 Cl12]'
_cell_volume [647.2541]
_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
[
  Ag  Ag0  4  0.2500  0.2500  0.5000  1.0
  Ag  Ag1  2  0.0000  0.5000  0.0000  1.0
  Ir  Ir2  2  0.0000  0.0000  0.5000  1.0
  I  I3  4  0.1837  0.5000  0.1905  1.0
  Cl  Cl4  8  0.0759  0.2203  0.7174  1.0
  Cl  Cl5  4  0.1302  0.0000  0.2767  1.0
]