data_[Dy12Ge2C4Se6]
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
  C  2.5500  0.7000  0.3000
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.4002]
_cell_length_b [3.8433]
_cell_length_c [8.1178]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.9682]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Dy6GeC2Se3]
_chemical_formula_sum '[Dy12 Ge2 C4 Se6]'
_cell_volume [524.4587]
_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  0.0185  0.0000  0.2588  1.0
  Dy  Dy1  4  0.1696  0.5000  0.1242  1.0
  Dy  Dy2  4  0.1790  0.5000  0.5588  1.0
  Ge  Ge3  2  0.0000  0.5000  0.0000  1.0
  Se  Se4  4  0.1627  0.0000  0.8309  1.0
  C  C5  4  0.1715  0.0000  0.3417  1.0
  Se  Se6  2  0.0000  0.5000  0.5000  1.0
]