data_[K4Dy4Zn4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Dy  1.2200  1.7500  1.1310
  Zn  1.6500  1.3500  0.8800
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.9899]
_cell_length_b [14.3929]
_cell_length_c [10.5955]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [KDyZnS3]
_chemical_formula_sum '[K4 Dy4 Zn4 S12]'
_cell_volume [608.4614]
_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
[
  K  K0  4  0.0000  0.2457  0.2500  1.0
  Dy  Dy1  4  0.0000  0.5000  0.0000  1.0
  Zn  Zn2  4  0.0000  0.0354  0.7500  1.0
  S  S3  8  0.0000  0.1220  0.5656  1.0
  S  S4  4  0.0000  0.4375  0.7500  1.0
]