data_[Li2Ga4I16]
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
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.6738]
_cell_length_b [11.0349]
_cell_length_c [6.8187]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.2758]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li(GaI4)2]
_chemical_formula_sum '[Li2 Ga4 I16]'
_cell_volume [1018.1518]
_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  2  0.0000  0.0000  0.0000  1.0
  Ga  Ga1  4  0.1899  0.0000  0.6460  1.0
  I  I2  8  0.0938  0.1864  0.7564  1.0
  I  I3  4  0.1296  0.5000  0.1865  1.0
  I  I4  4  0.1940  0.0000  0.2676  1.0
]