data_[Ce4Cd5In2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [8.0200]
_cell_length_b [3.2262]
_cell_length_c [10.7540]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.9776]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Ce4Cd5In2]
_chemical_formula_sum '[Ce4 Cd5 In2]'
_cell_volume [277.8749]
_cell_formula_units_Z [1]
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  0.1204  0.5000  0.9121  1.0
  Ce  Ce1  2  0.3327  0.5000  0.4582  1.0
  Cd  Cd2  2  0.2307  0.0000  0.1815  1.0
  Cd  Cd3  2  0.4098  0.0000  0.7297  1.0
  Cd  Cd4  1  0.5000  0.0000  0.0000  1.0
  In  In5  2  0.0443  0.0000  0.6359  1.0
]