data_[Li4Ho4Cd4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ho  1.2300  1.7500  1.0410
  Cd  1.6900  1.5500  1.0900
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [13.7933]
_cell_length_b [4.2978]
_cell_length_c [12.6606]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [LiHoCdTe3]
_chemical_formula_sum '[Li4 Ho4 Cd4 Te12]'
_cell_volume [750.5321]
_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  0.1132  0.2500  0.9826  1
  Ho  Ho1  4  0.0571  0.2500  0.3275  1
  Cd  Cd2  4  0.2338  0.2500  0.7151  1
  Te  Te3  4  0.0669  0.7500  0.1454  1
  Te  Te4  4  0.0761  0.2500  0.5795  1
  Te  Te5  4  0.2259  0.7500  0.8652  1
]