data_[Dy10Be2S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Be  1.5700  1.0500  0.5900
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [I4/m]
_cell_length_a [8.7827]
_cell_length_b [8.7827]
_cell_length_c [5.5376]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [87]
_chemical_formula_structural [Dy5BeS4]
_chemical_formula_sum '[Dy10 Be2 S8]'
_cell_volume [427.1515]
_cell_formula_units_Z [2]
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  8  0.0985  0.7051  0.0000  1
  Dy  Dy1  2  0.0000  0.0000  0.5000  1
  Be  Be2  2  0.0000  0.0000  0.0000  1
  S  S3  8  0.0973  0.6968  0.5000  1
]