data_[Tb3Bi3Te9]
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
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.4162]
_cell_length_b [4.4162]
_cell_length_c [31.9973]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [TbBiTe3]
_chemical_formula_sum '[Tb3 Bi3 Te9]'
_cell_volume [540.4382]
_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  3  0.0000  0.0000  0.6024  1.0
  Bi  Bi1  3  0.0000  0.0000  0.3981  1.0
  Te  Te2  3  0.0000  0.0000  0.2184  1.0
  Te  Te3  3  0.0000  0.0000  0.7844  1.0
  Te  Te4  3  0.0000  0.0000  0.9967  1.0
]