data_[In12Ga20Ag8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [11.6983]
_cell_length_b [12.5817]
_cell_length_c [5.9480]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [In3Ga5Ag2]
_chemical_formula_sum '[In12 Ga20 Ag8]'
_cell_volume [875.4626]
_cell_formula_units_Z [4]
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
[
  In  In0  8  0.1211  0.2436  0.0000  1.0
  In  In1  4  0.0000  0.0000  0.2500  1.0
  Ga  Ga2  8  0.1198  0.3610  0.5000  1.0
  Ga  Ga3  8  0.2464  0.5000  0.2500  1.0
  Ga  Ga4  4  0.0000  0.5000  0.2500  1.0
  Ag  Ag5  8  0.1444  0.1534  0.5000  1.0
]