[CIF]
data_Tl5Te2Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31332961
_cell_length_b   9.31332961
_cell_length_c   9.31332961
_cell_angle_alpha   120.74373441
_cell_angle_beta   120.74373441
_cell_angle_gamma   88.71657006
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl5Te2Br
_chemical_formula_sum   'Tl10 Te4 Br2'
_cell_volume   564.64040338
_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  1  0.00000000  0.00000000  0.00000000  1
  Tl  Tl1  1  0.00000000  0.00000000  6.65886200  1
  Tl  Tl2  1  1.35418829  5.95840729  4.65187433  1
  Tl  Tl3  1  -1.35418829  3.25003071  4.65187433  1
  Tl  Tl4  1  3.25003071  1.35418829  4.65187433  1
  Tl  Tl5  1  5.95840729  -1.35418829  4.65187433  1
  Tl  Tl6  1  3.25003071  -1.35418829  2.00698767  1
  Tl  Tl7  1  5.95840729  1.35418829  2.00698767  1
  Tl  Tl8  1  1.35418829  3.25003071  2.00698767  1
  Tl  Tl9  1  -1.35418829  5.95840729  2.00698767  1
  Te  Te10  1  3.16685089  -1.43736811  6.65886200  1
  Te  Te11  1  1.43736811  6.04158711  -0.00000000  1
  Te  Te12  1  1.43736811  3.16685089  6.65886200  1
  Te  Te13  1  3.16685089  1.43736811  -0.00000000  1
  Br  Br14  1  0.00000000  0.00000000  9.98829300  1
  Br  Br15  1  0.00000000  -0.00000000  3.32943100  1
[/CIF]
