data_[Ce2Dy2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Dy  1.2200  1.7500  1.1310
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.8403]
_cell_length_b [3.9432]
_cell_length_c [7.8614]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.3856]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CeDyS3]
_chemical_formula_sum '[Ce2 Dy2 S6]'
_cell_volume [242.3329]
_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
[
  Ce  Ce0  2  0.2317  0.2500  0.3803  1.0
  Dy  Dy1  2  0.3243  0.2500  0.8544  1.0
  S  S2  2  0.0226  0.2500  0.6810  1.0
  S  S3  2  0.3209  0.7500  0.0996  1.0
  S  S4  2  0.3845  0.7500  0.6245  1.0
]