data_[Li3Tb9Zn24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Tb  1.1000  1.7500  0.9815
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.4020]
_cell_length_b [5.4020]
_cell_length_c [26.6480]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [LiTb3Zn8]
_chemical_formula_sum '[Li3 Tb9 Zn24]'
_cell_volume [673.4486]
_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
[
  Li  Li0  3  0.0000  0.0000  0.8725  1.0
  Tb  Tb1  3  0.0000  0.0000  0.3781  1.0
  Tb  Tb2  3  0.0000  0.0000  0.5033  1.0
  Tb  Tb3  3  0.0000  0.0000  0.9941  1.0
  Zn  Zn4  9  0.0004  0.5002  0.4385  1.0
  Zn  Zn5  9  0.1679  0.8321  0.2703  1.0
  Zn  Zn6  3  0.0000  0.0000  0.1883  1.0
  Zn  Zn7  3  0.0000  0.0000  0.6873  1.0
]