data_[Dy12Sb4S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [10.5979]
_cell_length_b [13.3637]
_cell_length_c [6.8004]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Dy3SbS6]
_chemical_formula_sum '[Dy12 Sb4 S24]'
_cell_volume [963.1205]
_cell_formula_units_Z [4]
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  8  0.1854  0.1007  0.9823  1.0
  Dy  Dy1  4  0.0000  0.4047  0.8893  1.0
  Sb  Sb2  4  0.0000  0.1785  0.5005  1.0
  S  S3  8  0.1653  0.4702  0.1820  1.0
  S  S4  8  0.1677  0.2670  0.6992  1.0
  S  S5  4  0.0000  0.0109  0.7490  1.0
  S  S6  4  0.0000  0.2309  0.1195  1.0
]