data_[Ba6Al2Ag2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Al  1.6100  1.2500  0.6750
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.7591]
_cell_length_b [4.6814]
_cell_length_c [9.9066]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.2936]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ba3AlAg]
_chemical_formula_sum '[Ba6 Al2 Ag2]'
_cell_volume [418.7646]
_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
[
  Ba  Ba0  2  0.0929  0.2500  0.2275  1
  Ba  Ba1  2  0.3102  0.2500  0.9256  1
  Ba  Ba2  2  0.3558  0.7500  0.5846  1
  Al  Al3  2  0.0404  0.2500  0.5669  1
  Ag  Ag4  2  0.3714  0.7500  0.2041  1
]