data_[Tl16In4Ga2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [9.8050]
_cell_length_b [12.6488]
_cell_length_c [5.4231]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Tl8In2Ga]
_chemical_formula_sum '[Tl16 In4 Ga2]'
_cell_volume [672.5834]
_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
[
  Tl  Tl0  8  0.1709  0.1321  0.0000  1
  Tl  Tl1  4  0.0000  0.2444  0.5000  1
  Tl  Tl2  4  0.1783  0.5000  0.5000  1
  In  In3  4  0.0000  0.3791  0.0000  1
  Ga  Ga4  2  0.0000  0.0000  0.5000  1
]