data_[Cd3Ga3Ag6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.5450]
_cell_length_b [4.5450]
_cell_length_c [13.7519]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [CdGaAg2]
_chemical_formula_sum '[Cd3 Ga3 Ag6]'
_cell_volume [246.0169]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.4863  1.0
  Ga  Ga1  3  0.0000  0.0000  0.6869  1.0
  Ag  Ag2  3  0.0000  0.0000  0.0579  1.0
  Ag  Ag3  3  0.0000  0.0000  0.2689  1.0
]