data_[Dy8Pt8Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Pt  2.2800  1.3500  0.8050
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [22.9823]
_cell_length_b [4.0051]
_cell_length_c [7.7876]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.0260]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [DyPtBr]
_chemical_formula_sum '[Dy8 Pt8 Br8]'
_cell_volume [715.0491]
_cell_formula_units_Z [8]
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  0.1604  0.5000  0.5993  1
  Dy  Dy1  4  0.1643  0.5000  0.1143  1
  Pt  Pt2  4  0.2456  0.0000  0.6230  1
  Pt  Pt3  4  0.2493  0.5000  0.8739  1
  Br  Br4  4  0.0738  0.5000  0.8424  1
  Br  Br5  4  0.0940  0.0000  0.3422  1
]