data_[Li12Ga16Sn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.1220]
_cell_length_b [10.0534]
_cell_length_c [5.8963]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.7666]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li3(Ga2Sn)2]
_chemical_formula_sum '[Li12 Ga16 Sn8]'
_cell_volume [718.2228]
_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  8  0.1148  0.0569  0.1704  1
  Li  Li1  4  0.0000  0.4963  0.7500  1
  Ga  Ga2  8  0.0445  0.2072  0.5349  1
  Ga  Ga3  8  0.1588  0.3147  0.9724  1
  Sn  Sn4  8  0.2061  0.4040  0.4774  1
]