data_[Cd1In8Ag6]
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 [P-3]
_cell_length_a [7.4168]
_cell_length_b [7.4168]
_cell_length_c [7.3512]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [147]
_chemical_formula_structural [Cd(In4Ag3)2]
_chemical_formula_sum '[Cd1 In8 Ag6]'
_cell_volume [350.2062]
_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  0.0000  0.0000  0.5000  1
  In  In1  6  0.1037  0.3185  0.1761  1
  In  In2  2  0.3333  0.6667  0.9058  1
  Ag  Ag3  6  0.1281  0.4256  0.5789  1
]