data_[Li8Cd20Ga8]
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 [Ima2]
_cell_length_a [17.8196]
_cell_length_b [5.0837]
_cell_length_c [8.0250]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [46]
_chemical_formula_structural [Li2Cd5Ga2]
_chemical_formula_sum '[Li8 Cd20 Ga8]'
_cell_volume [726.9793]
_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  0.0000  0.8774  1
  Li  Li1  4  0.2500  0.0434  0.1831  1
  Cd  Cd2  8  0.0846  0.5410  0.7062  1
  Cd  Cd3  8  0.1663  0.0195  0.8680  1
  Cd  Cd4  4  0.2500  0.5397  0.0240  1
  Ga  Ga5  8  0.0773  0.0421  0.5514  1
]