data_[Li8In20Ga8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Ima2]
_cell_length_a [12.1058]
_cell_length_b [10.1319]
_cell_length_c [6.8398]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [46]
_chemical_formula_structural [Li2In5Ga2]
_chemical_formula_sum '[Li8 In20 Ga8]'
_cell_volume [838.9365]
_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  0.8240  1.0
  Li  Li1  4  0.2500  0.5553  0.6801  1.0
  In  In2  8  0.1138  0.1986  0.1263  1.0
  In  In3  8  0.1167  0.7455  0.9351  1.0
  In  In4  4  0.2500  0.0346  0.7872  1.0
  Ga  Ga5  8  0.1057  0.0385  0.4610  1.0
]