data_[Cd8In4F20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.2633]
_cell_length_b [13.7694]
_cell_length_c [10.1112]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Cd2InF5]
_chemical_formula_sum '[Cd8 In4 F20]'
_cell_volume [593.5525]
_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
[
  Cd  Cd0  8  0.0000  0.1145  0.6186  1.0
  In  In1  4  0.0000  0.1809  0.2500  1.0
  F  F2  8  0.0000  0.0765  0.0957  1.0
  F  F3  8  0.0000  0.2874  0.0993  1.0
  F  F4  4  0.0000  0.3257  0.7500  1.0
]