data_[Dy8Pu4Cu4S20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Pu  1.2800  1.7500  0.9675
  Cu  1.9000  1.3500  0.8200
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.8195]
_cell_length_b [17.3424]
_cell_length_c [11.1912]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Dy2PuCuS5]
_chemical_formula_sum '[Dy8 Pu4 Cu4 S20]'
_cell_volume [741.3023]
_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  0.0000  0.0992  0.6840  1
  Dy  Dy1  4  0.0000  0.1151  0.3075  1
  Pu  Pu2  4  0.0000  0.1998  0.0094  1
  Cu  Cu3  4  0.0000  0.4392  0.4544  1
  S  S4  4  0.0000  0.0471  0.0635  1
  S  S5  4  0.0000  0.2955  0.6844  1
  S  S6  4  0.0000  0.3245  0.3397  1
  S  S7  4  0.0000  0.3616  0.0029  1
  S  S8  4  0.0000  0.4970  0.7783  1
]