data_[Na8Cd8Ga4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Cd  1.6900  1.5500  1.0900
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.8891]
_cell_length_b [5.0117]
_cell_length_c [9.3931]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.6727]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na2Cd2Ga]
_chemical_formula_sum '[Na8 Cd8 Ga4]'
_cell_volume [495.8868]
_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
[
  Na  Na0  4  0.0536  0.5000  0.3577  1
  Na  Na1  4  0.1727  0.5000  0.0546  1
  Cd  Cd2  4  0.0061  0.0000  0.8502  1
  Cd  Cd3  4  0.1358  0.0000  0.5996  1
  Ga  Ga4  4  0.2420  0.0000  0.3291  1
]