data_[Li4Tb4Ce8Te20]
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
  Ce  1.1200  1.8500  1.0800
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.4359]
_cell_length_b [18.7578]
_cell_length_c [13.2148]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [LiTbCe2Te5]
_chemical_formula_sum '[Li4 Tb4 Ce8 Te20]'
_cell_volume [1099.5700]
_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  0.0000  0.4420  0.4613  1
  Tb  Tb1  4  0.0000  0.1984  0.0092  1
  Ce  Ce2  4  0.0000  0.1069  0.6846  1
  Ce  Ce3  4  0.0000  0.1257  0.3034  1
  Te  Te4  4  0.0000  0.0462  0.0701  1
  Te  Te5  4  0.0000  0.2850  0.6702  1
  Te  Te6  4  0.0000  0.3112  0.3463  1
  Te  Te7  4  0.0000  0.3627  0.9994  1
  Te  Te8  4  0.0000  0.4978  0.7794  1
]