data_[Tl4Zn8Ga40]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [5.4954]
_cell_length_b [13.7433]
_cell_length_c [13.7945]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Tl(ZnGa5)2]
_chemical_formula_sum '[Tl4 Zn8 Ga40]'
_cell_volume [1041.8217]
_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
[
  Tl  Tl0  4  0.0000  0.0000  0.0000  1.0
  Zn  Zn1  8  0.2500  0.2500  0.0000  1.0
  Ga  Ga2  16  0.0000  0.1102  0.3944  1.0
  Ga  Ga3  16  0.0000  0.1809  0.1757  1.0
  Ga  Ga4  8  0.2500  0.0000  0.2500  1.0
]