data_[Dy12Ho3Pu3S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Ho  1.2300  1.7500  1.0410
  Pu  1.2800  1.7500  0.9675
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.0945]
_cell_length_b [8.0945]
_cell_length_c [19.7912]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Dy4HoPuS8]
_chemical_formula_sum '[Dy12 Ho3 Pu3 S24]'
_cell_volume [1122.9989]
_cell_formula_units_Z [3]
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  9  0.1686  0.3371  0.8328  1
  Dy  Dy1  3  0.0000  0.0000  0.6248  1
  Ho  Ho2  3  0.0000  0.0000  0.0015  1
  Pu  Pu3  3  0.0000  0.0000  0.3753  1
  S  S4  9  0.0303  0.5152  0.7533  1
  S  S5  9  0.1775  0.3549  0.5811  1
  S  S6  3  0.0000  0.0000  0.2390  1
  S  S7  3  0.0000  0.0000  0.7577  1
]