data_[Na3Tb12Dy3S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Tb  1.1000  1.7500  0.9815
  Dy  1.2200  1.7500  1.1310
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.1372]
_cell_length_b [8.1372]
_cell_length_c [19.8891]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [NaTb4DyS8]
_chemical_formula_sum '[Na3 Tb12 Dy3 S24]'
_cell_volume [1140.5122]
_cell_formula_units_Z [3]
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
[
  Na  Na0  3  0.0000  0.0000  0.3752  1.0
  Tb  Tb1  9  0.1725  0.3450  0.8319  1.0
  Tb  Tb2  3  0.0000  0.0000  0.6249  1.0
  Dy  Dy3  3  0.0000  0.0000  0.0045  1.0
  S  S4  9  0.0301  0.5151  0.7533  1.0
  S  S5  9  0.1778  0.3555  0.5810  1.0
  S  S6  3  0.0000  0.0000  0.2390  1.0
  S  S7  3  0.0000  0.0000  0.7580  1.0
]