data_[Gd2Dy2C2S2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Gd  1.2000  1.8000  1.0750
  Dy  1.2200  1.7500  1.1310
  C  2.5500  0.7000  0.3000
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [3.7278]
_cell_length_b [3.7278]
_cell_length_c [13.0026]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [GdDyCS]
_chemical_formula_sum '[Gd2 Dy2 C2 S2]'
_cell_volume [156.4832]
_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
[
  Gd  Gd0  2  0.3333  0.6667  0.8941  1
  Dy  Dy1  2  0.3333  0.6667  0.6032  1
  C  C2  1  0.0000  0.0000  0.0000  1
  C  C3  1  0.0000  0.0000  0.5000  1
  S  S4  2  0.3333  0.6667  0.2526  1
]