data_[Tb9Tl3Cu24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Tl  1.6200  1.9000  1.3325
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.1829]
_cell_length_b [5.1829]
_cell_length_c [25.5692]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Tb3TlCu8]
_chemical_formula_sum '[Tb9 Tl3 Cu24]'
_cell_volume [594.8358]
_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  0.3781  1.0
  Tb  Tb1  3  0.0000  0.0000  0.5030  1.0
  Tb  Tb2  3  0.0000  0.0000  0.9954  1.0
  Tl  Tl3  3  0.0000  0.0000  0.8716  1.0
  Cu  Cu4  9  0.0057  0.5028  0.9389  1.0
  Cu  Cu5  9  0.1682  0.3365  0.7698  1.0
  Cu  Cu6  3  0.0000  0.0000  0.1883  1.0
  Cu  Cu7  3  0.0000  0.0000  0.6874  1.0
]