data_[Tb4Ce8Pd4S20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ce  1.1200  1.8500  1.0800
  Pd  2.2000  1.4000  0.8462
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.8832]
_cell_length_b [16.4262]
_cell_length_c [11.9713]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [TbCe2PdS5]
_chemical_formula_sum '[Tb4 Ce8 Pd4 S20]'
_cell_volume [763.6013]
_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
[
  Tb  Tb0  4  0.0000  0.1758  0.0256  1
  Ce  Ce1  4  0.0000  0.1101  0.3513  1
  Ce  Ce2  4  0.0000  0.1206  0.6969  1
  Pd  Pd3  4  0.0000  0.4478  0.4199  1
  S  S4  4  0.0000  0.0073  0.0224  1
  S  S5  4  0.0000  0.3051  0.6887  1
  S  S6  4  0.0000  0.3061  0.3573  1
  S  S7  4  0.0000  0.3420  0.0218  1
  S  S8  4  0.0000  0.4957  0.7401  1
]