data_[U2Tl6Te12Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Tl  1.6200  1.9000  1.3325
  Te  2.1000  1.4000  1.2933
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.8181]
_cell_length_b [15.1928]
_cell_length_c [8.1152]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.9712]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [UTl3(Te3Au)2]
_chemical_formula_sum '[U2 Tl6 Te12 Au4]'
_cell_volume [794.9513]
_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
[
  U  U0  2  0.0000  0.0000  0.0000  1
  Tl  Tl1  4  0.0000  0.1879  0.5000  1
  Tl  Tl2  2  0.0000  0.5000  0.5000  1
  Te  Te3  8  0.2368  0.3528  0.8047  1
  Te  Te4  4  0.1817  0.0000  0.7199  1
  Au  Au5  4  0.0000  0.4028  0.0000  1
]