data_[Ba2Ag6Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ag  1.9300  1.6000  1.0867
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.7076]
_cell_length_b [5.0302]
_cell_length_c [5.2221]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.6099]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [BaAg3Pb]
_chemical_formula_sum '[Ba2 Ag6 Pb2]'
_cell_volume [277.3211]
_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  0.3931  0.5000  0.6878  1.0
  Ag  Ag1  2  0.1443  0.5000  0.8833  1.0
  Ag  Ag2  2  0.1468  0.0000  0.5214  1.0
  Ag  Ag3  2  0.2515  0.0000  0.1176  1.0
  Pb  Pb4  2  0.0256  0.5000  0.2710  1.0
]