data_[Tb6Bi2Sb2S2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Bi  2.0200  1.6000  1.0350
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.8483]
_cell_length_b [4.4698]
_cell_length_c [9.6854]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.1980]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Tb3BiSbS]
_chemical_formula_sum '[Tb6 Bi2 Sb2 S2]'
_cell_volume [378.1282]
_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
[
  Tb  Tb0  2  0.1084  0.7500  0.8690  1
  Tb  Tb1  2  0.1954  0.2500  0.4894  1
  Tb  Tb2  2  0.4054  0.2500  0.1431  1
  Bi  Bi3  2  0.1683  0.7500  0.2115  1
  Sb  Sb4  2  0.3484  0.2500  0.8263  1
  S  S5  2  0.1084  0.7500  0.5942  1
]