data_[Li4Tb6Cd10]
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
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.5110]
_cell_length_b [10.5110]
_cell_length_c [4.1588]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Li2Tb3Cd5]
_chemical_formula_sum '[Li4 Tb6 Cd10]'
_cell_volume [459.4666]
_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
[
  Li  Li0  4  0.1147  0.6147  0.0000  1
  Tb  Tb1  4  0.1793  0.3207  0.0000  1
  Tb  Tb2  2  0.0000  0.0000  0.0000  1
  Cd  Cd3  8  0.0612  0.7830  0.5000  1
  Cd  Cd4  2  0.0000  0.5000  0.5000  1
]