data_[Cs3In2Ag1Cl9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [7.5706]
_cell_length_b [7.5706]
_cell_length_c [9.3139]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Cs3In2AgCl9]
_chemical_formula_sum '[Cs3 In2 Ag1 Cl9]'
_cell_volume [462.2990]
_cell_formula_units_Z [1]
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  2  0.3333  0.6667  0.3402  1.0
  Cs  Cs1  1  0.0000  0.0000  0.0000  1.0
  In  In2  2  0.3333  0.6667  0.8272  1.0
  Ag  Ag3  1  0.0000  0.0000  0.5000  1.0
  Cl  Cl4  6  0.1688  0.3377  0.6736  1.0
  Cl  Cl5  3  0.0000  0.5000  0.0000  1.0
]