data_[Dy8Ge1S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Ge  2.0100  1.2500  0.7700
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P-3]
_cell_length_a [10.0908]
_cell_length_b [10.0908]
_cell_length_c [3.9355]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [147]
_chemical_formula_structural [Dy8GeS6]
_chemical_formula_sum '[Dy8 Ge1 S6]'
_cell_volume [347.0432]
_cell_formula_units_Z [1]
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  6  0.0329  0.3270  0.2549  1
  Dy  Dy1  2  0.3333  0.6667  0.7477  1
  Ge  Ge2  1  0.0000  0.0000  0.5000  1
  S  S3  6  0.1345  0.6522  0.2487  1
]