data_[In4Ga8Sn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  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 [10.9904]
_cell_length_b [9.1158]
_cell_length_c [6.2093]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.2560]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [In(GaSn)2]
_chemical_formula_sum '[In4 Ga8 Sn8]'
_cell_volume [537.3510]
_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
[
  In  In0  4  0.0000  0.3610  0.2500  1.0
  Ga  Ga1  4  0.0000  0.0035  0.7500  1.0
  Ga  Ga2  4  0.0000  0.3284  0.7500  1.0
  Sn  Sn3  8  0.2099  0.1575  0.1922  1.0
]