data_[Cd2In2Ag28]
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 [Amm2]
_cell_length_a [9.7179]
_cell_length_b [5.9609]
_cell_length_c [10.1364]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [CdInAg14]
_chemical_formula_sum '[Cd2 In2 Ag28]'
_cell_volume [587.1809]
_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  0.5000  0.0000  0.5449  1
  In  In1  2  0.5000  0.0000  0.0451  1
  Ag  Ag2  8  0.2447  0.2494  0.6252  1
  Ag  Ag3  4  0.0000  0.2498  0.9559  1
  Ag  Ag4  4  0.2458  0.0000  0.8740  1
  Ag  Ag5  4  0.2459  0.0000  0.3742  1
  Ag  Ag6  4  0.5000  0.2500  0.7945  1
  Ag  Ag7  2  0.0000  0.0000  0.2058  1
  Ag  Ag8  2  0.0000  0.0000  0.7059  1
]