data_[La20Mg4Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.6029]
_cell_length_b [8.7128]
_cell_length_c [12.8880]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.0354]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La5MgCd]
_chemical_formula_sum '[La20 Mg4 Cd4]'
_cell_volume [937.1899]
_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
[
  La  La0  8  0.1435  0.3646  0.0616  1
  La  La1  8  0.2122  0.3013  0.3619  1
  La  La2  4  0.0000  0.0113  0.2500  1
  Mg  Mg3  4  0.0000  0.3792  0.7500  1
  Cd  Cd4  4  0.0000  0.0000  0.0000  1
]