data_[La4Cu4Te8Pb4S4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Cu  1.9000  1.3500  0.8200
  Te  2.1000  1.4000  1.2933
  Pb  2.3300  1.8000  1.1225
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.2726]
_cell_length_b [14.5072]
_cell_length_c [10.8601]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [LaCuTe2PbS]
_chemical_formula_sum '[La4 Cu4 Te8 Pb4 S4]'
_cell_volume [673.1428]
_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
[
  La  La0  4  0.0000  0.5000  0.0000  1
  Cu  Cu1  4  0.0000  0.0247  0.7500  1
  Te  Te2  8  0.0000  0.1532  0.5743  1
  Pb  Pb3  4  0.0000  0.2288  0.2500  1
  S  S4  4  0.0000  0.4383  0.7500  1
]