[CIF]
data_Tl2HgTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47315240
_cell_length_b   6.47315240
_cell_length_c   6.47315240
_cell_angle_alpha   140.31110012
_cell_angle_beta   131.27760020
_cell_angle_gamma   64.58121981
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2HgTe
_chemical_formula_sum   'Tl2 Hg1 Te1'
_cell_volume   128.42606803
_cell_formula_units_Z   1
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
  Hg  Hg0  1  0.00000000  2.67009529  0.13577970  1
  Te  Te1  1  -0.00000000  0.00000000  8.25208899  1
  Tl  Tl2  1  0.00000000  2.67009529  5.27652297  1
  Tl  Tl3  1  -0.00000000  0.00000000  2.75183474  1
[/CIF]
