data_[In12Ga4Sn2]
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/m]
_cell_length_a [12.7181]
_cell_length_b [3.4573]
_cell_length_c [11.2998]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1185]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [In6Ga2Sn]
_chemical_formula_sum '[In12 Ga4 Sn2]'
_cell_volume [469.4463]
_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
[
  In  In0  4  0.0338  0.0000  0.7018  1.0
  In  In1  4  0.1593  0.5000  0.5435  1.0
  In  In2  4  0.2355  0.5000  0.8777  1.0
  Ga  Ga3  4  0.1411  0.5000  0.2545  1.0
  Sn  Sn4  2  0.0000  0.0000  0.0000  1.0
]