data_[Li16Ga4Sb2]
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
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.1062]
_cell_length_b [4.4739]
_cell_length_c [5.2945]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.9532]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li8Ga2Sb]
_chemical_formula_sum '[Li16 Ga4 Sb2]'
_cell_volume [357.7705]
_cell_formula_units_Z [2]
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  0.0479  0.0000  0.7373  1.0
  Li  Li1  4  0.1004  0.5000  0.4609  1.0
  Li  Li2  4  0.1346  0.0000  0.1650  1.0
  Li  Li3  4  0.1904  0.5000  0.8988  1.0
  Ga  Ga4  4  0.2196  0.0000  0.6137  1.0
  Sb  Sb5  2  0.0000  0.5000  0.0000  1.0
]