data_[Cd2In10Ag16]
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
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [8.5458]
_cell_length_b [8.5458]
_cell_length_c [8.2785]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [CdIn5Ag8]
_chemical_formula_sum '[Cd2 In10 Ag16]'
_cell_volume [604.5834]
_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
[
  Cd  Cd0  2  0.0000  0.5000  0.2500  1
  In  In1  8  0.1292  0.7553  0.8789  1
  In  In2  2  0.0000  0.0000  0.5000  1
  Ag  Ag3  8  0.0841  0.6569  0.5437  1
  Ag  Ag4  8  0.0884  0.8383  0.2154  1
]