data_[Dy12Ge6P2S4]
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
  P  2.1900  1.0000  0.5500
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.8062]
_cell_length_b [4.0183]
_cell_length_c [8.1734]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.4672]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Dy6Ge3PS2]
_chemical_formula_sum '[Dy12 Ge6 P2 S4]'
_cell_volume [563.6391]
_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  4  0.0018  0.0000  0.2430  1
  Dy  Dy1  4  0.1642  0.5000  0.0839  1
  Dy  Dy2  4  0.1679  0.5000  0.5816  1
  Ge  Ge3  4  0.1675  0.0000  0.8322  1
  Ge  Ge4  2  0.0000  0.5000  0.5000  1
  P  P5  2  0.0000  0.5000  0.0000  1
  S  S6  4  0.1674  0.0000  0.3345  1
]