data_[Li4Cd4Ga16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cd  1.6900  1.5500  1.0900
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [19.2321]
_cell_length_b [4.5577]
_cell_length_c [5.4033]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.7535]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiCdGa4]
_chemical_formula_sum '[Li4 Cd4 Ga16]'
_cell_volume [471.9968]
_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
[
  Li  Li0  4  0.0000  0.1555  0.7500  1.0
  Cd  Cd1  4  0.2500  0.2500  0.0000  1.0
  Ga  Ga2  8  0.0718  0.3555  0.2261  1.0
  Ga  Ga3  8  0.1386  0.1417  0.6778  1.0
]