data_[Cs8U4Pd4S20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  U  1.3800  1.7500  0.9913
  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 [4.1827]
_cell_length_b [20.9909]
_cell_length_c [14.2846]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Cs2UPdS5]
_chemical_formula_sum '[Cs8 U4 Pd4 S20]'
_cell_volume [1254.1813]
_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
[
  Cs  Cs0  4  0.0000  0.1152  0.6923  1
  Cs  Cs1  4  0.0000  0.1215  0.3294  1
  U  U2  4  0.0000  0.2090  0.0202  1
  Pd  Pd3  4  0.0000  0.3985  0.4130  1
  S  S4  4  0.0000  0.0864  0.9794  1
  S  S5  4  0.0000  0.2851  0.4056  1
  S  S6  4  0.0000  0.3007  0.6358  1
  S  S7  4  0.0000  0.3253  0.0189  1
  S  S8  4  0.0000  0.4907  0.3294  1
]