data_[Cd2In6Ga2]
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 [P2_1/m]
_cell_length_a [4.8154]
_cell_length_b [6.6423]
_cell_length_c [8.2084]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.1890]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CdIn3Ga]
_chemical_formula_sum '[Cd2 In6 Ga2]'
_cell_volume [253.3758]
_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  2  0.0064  0.7500  0.4849  1.0
  In  In1  4  0.4061  0.5041  0.2894  1.0
  In  In2  2  0.1984  0.7500  0.8929  1.0
  Ga  Ga3  2  0.1848  0.2500  0.8891  1.0
]