data_[Ce2Mg2Cd22]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.9626]
_cell_length_b [14.0716]
_cell_length_c [7.6643]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.7236]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeMgCd11]
_chemical_formula_sum '[Ce2 Mg2 Cd22]'
_cell_volume [593.1490]
_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
[
  Ce  Ce0  2  0.0000  0.0000  0.0000  1
  Mg  Mg1  2  0.0000  0.5000  0.5000  1
  Cd  Cd2  8  0.1020  0.3938  0.2142  1
  Cd  Cd3  8  0.1795  0.1744  0.3518  1
  Cd  Cd4  4  0.2500  0.2500  0.0000  1
  Cd  Cd5  2  0.0000  0.0000  0.5000  1
]