data_[Ba16Ga4Ag4]
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 [C2/c]
_cell_length_a [10.9032]
_cell_length_b [15.7158]
_cell_length_c [7.8564]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.9714]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Ba4GaAg]
_chemical_formula_sum '[Ba16 Ga4 Ag4]'
_cell_volume [1089.4961]
_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  0.1313  0.1851  0.1001  1.0
  Ba  Ba1  8  0.1902  0.4451  0.2553  1.0
  Ga  Ga2  4  0.0000  0.3657  0.7500  1.0
  Ag  Ag3  4  0.0000  0.0004  0.2500  1.0
]