data_[Ba4Na2Ag2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Na  0.9300  1.8000  1.1600
  Ag  1.9300  1.6000  1.0867
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.0659]
_cell_length_b [8.0565]
_cell_length_c [12.2021]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.6882]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ba2NaAgCl6]
_chemical_formula_sum '[Ba4 Na2 Ag2 Cl12]'
_cell_volume [571.1616]
_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  4  0.2138  0.1048  0.2506  1.0
  Na  Na1  2  0.5000  0.0000  0.0000  1.0
  Ag  Ag2  2  0.0000  0.0000  0.5000  1.0
  Cl  Cl3  4  0.1166  0.1760  0.9402  1.0
  Cl  Cl4  4  0.2698  0.6853  0.9406  1.0
  Cl  Cl5  4  0.3711  0.0372  0.7446  1.0
]