data_[Tl4Ge2Sb2Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Ge  2.0100  1.2500  0.7700
  Sb  2.0500  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [7.0425]
_cell_length_b [8.1937]
_cell_length_c [8.6718]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Tl2GeSbAu6]
_chemical_formula_sum '[Tl4 Ge2 Sb2 Au12]'
_cell_volume [500.3954]
_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  4  0.0000  0.2434  0.7099  1.0
  Ge  Ge1  2  0.0000  0.0000  0.2451  1.0
  Sb  Sb2  2  0.0000  0.5000  0.3210  1.0
  Au  Au3  4  0.0000  0.2640  0.0938  1.0
  Au  Au4  4  0.2052  0.5000  0.9269  1.0
  Au  Au5  4  0.2098  0.0000  0.4846  1.0
]