data_[Ba24Ga8Ag4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [10.9334]
_cell_length_b [11.6146]
_cell_length_c [12.5674]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Ba6Ga2Ag]
_chemical_formula_sum '[Ba24 Ga8 Ag4]'
_cell_volume [1595.9026]
_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
[
  Ba  Ba0  8  0.0000  0.2214  0.2094  1.0
  Ba  Ba1  8  0.2001  0.3227  0.5000  1.0
  Ba  Ba2  8  0.2250  0.5000  0.1678  1.0
  Ga  Ga3  4  0.0000  0.3889  0.0000  1.0
  Ga  Ga4  4  0.0000  0.5000  0.3660  1.0
  Ag  Ag5  2  0.0000  0.0000  0.0000  1.0
  Ag  Ag6  2  0.0000  0.0000  0.5000  1.0
]