data_[Cd1Ag1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.2426]
_cell_length_b [5.3351]
_cell_length_c [5.7867]
_cell_angle_alpha [64.6908]
_cell_angle_beta [63.5337]
_cell_angle_gamma [61.7376]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CdAgF6]
_chemical_formula_sum '[Cd1 Ag1 F6]'
_cell_volume [122.7146]
_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
[
  Cd  Cd0  1  0.5000  0.5000  0.5000  1.0
  Ag  Ag1  1  0.0000  0.0000  0.0000  1.0
  F  F2  2  0.0776  0.7745  0.7641  1.0
  F  F3  2  0.2371  0.6051  0.2469  1.0
  F  F4  2  0.3796  0.0848  0.7668  1.0
]