data_[Ba8Ga4Ag8]
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/m]
_cell_length_a [12.5332]
_cell_length_b [4.7037]
_cell_length_c [12.6603]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.7550]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2GaAg2]
_chemical_formula_sum '[Ba8 Ga4 Ag8]'
_cell_volume [666.4510]
_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  4  0.0937  0.0000  0.8924  1.0
  Ba  Ba1  4  0.1984  0.5000  0.6411  1.0
  Ga  Ga2  4  0.0722  0.5000  0.3255  1.0
  Ag  Ag3  4  0.0445  0.0000  0.4118  1.0
  Ag  Ag4  4  0.1108  0.5000  0.1205  1.0
]