data_[Cd1In3Ag8]
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 [P3m1]
_cell_length_a [5.6095]
_cell_length_b [5.6095]
_cell_length_c [9.0421]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [CdIn3Ag8]
_chemical_formula_sum '[Cd1 In3 Ag8]'
_cell_volume [246.4066]
_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  0.5506  1
  In  In1  1  0.0000  0.0000  0.9282  1
  In  In2  1  0.6667  0.3333  0.0673  1
  In  In3  1  0.6667  0.3333  0.4491  1
  Ag  Ag4  3  0.1634  0.3268  0.2511  1
  Ag  Ag5  3  0.5031  0.0062  0.7501  1
  Ag  Ag6  1  0.3333  0.6667  0.0010  1
  Ag  Ag7  1  0.3333  0.6667  0.5003  1
]