data_[Tb12Ag3Bi3S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ag  1.9300  1.6000  1.0867
  Bi  2.0200  1.6000  1.0350
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.0820]
_cell_length_b [8.0820]
_cell_length_c [19.9861]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Tb4AgBiS8]
_chemical_formula_sum '[Tb12 Ag3 Bi3 S24]'
_cell_volume [1130.5727]
_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
[
  Tb  Tb0  9  0.0084  0.5042  0.5005  1.0
  Tb  Tb1  3  0.0000  0.0000  0.3744  1.0
  Ag  Ag2  3  0.0000  0.0000  0.6301  1.0
  Bi  Bi3  3  0.0000  0.0000  0.9912  1.0
  S  S4  9  0.0171  0.5085  0.7551  1.0
  S  S5  9  0.1739  0.3479  0.5788  1.0
  S  S6  3  0.0000  0.0000  0.2416  1.0
  S  S7  3  0.0000  0.0000  0.7594  1.0
]