data_[Dy4Ag4Pb4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Ag  1.9300  1.6000  1.0867
  Pb  2.3300  1.8000  1.1225
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [10.4710]
_cell_length_b [4.0338]
_cell_length_c [13.1702]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [DyAgPbS3]
_chemical_formula_sum '[Dy4 Ag4 Pb4 S12]'
_cell_volume [556.2798]
_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
[
  Dy  Dy0  4  0.0198  0.2500  0.7396  1
  Ag  Ag1  4  0.2339  0.2500  0.2182  1
  Pb  Pb2  4  0.2162  0.7500  0.9978  1
  S  S3  4  0.0317  0.2500  0.1158  1
  S  S4  4  0.0751  0.7500  0.6071  1
  S  S5  4  0.2345  0.7500  0.3389  1
]