data_[Cd4In12Ga2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.4006]
_cell_length_b [3.2219]
_cell_length_c [11.1569]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.7828]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd2In6Ga]
_chemical_formula_sum '[Cd4 In12 Ga2]'
_cell_volume [475.6051]
_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
[
  Cd  Cd0  4  0.1336  0.5000  0.2725  1.0
  In  In1  4  0.0525  0.0000  0.7303  1.0
  In  In2  4  0.1525  0.5000  0.5649  1.0
  In  In3  4  0.2098  0.0000  0.0820  1.0
  Ga  Ga4  2  0.0000  0.0000  0.0000  1.0
]