data_[Zn4In6Ga8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.3587]
_cell_length_b [4.2294]
_cell_length_c [8.5833]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5889]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zn2In3Ga4]
_chemical_formula_sum '[Zn4 In6 Ga8]'
_cell_volume [388.4807]
_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
[
  Zn  Zn0  4  0.0940  0.5000  0.2613  1
  In  In1  4  0.1939  0.5000  0.6248  1
  In  In2  2  0.0000  0.0000  0.0000  1
  Ga  Ga3  4  0.0116  0.0000  0.6594  1
  Ga  Ga4  4  0.2494  0.5000  0.0929  1
]