data_[Li4Tb4Ga8]
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
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [7.3863]
_cell_length_b [3.7731]
_cell_length_c [11.5697]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [LiTbGa2]
_chemical_formula_sum '[Li4 Tb4 Ga8]'
_cell_volume [322.4462]
_cell_formula_units_Z [4]
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  4  0.1174  0.2500  0.5461  1.0
  Tb  Tb1  4  0.1399  0.2500  0.8608  1.0
  Ga  Ga2  4  0.0330  0.2500  0.3282  1.0
  Ga  Ga3  4  0.1874  0.2500  0.1340  1.0
]