[CIF]
data_Tl2PBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.82441979
_cell_length_b   3.82441979
_cell_length_c   8.84258120
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   93.50881407
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2PBr
_chemical_formula_sum   'Tl2 P1 Br1'
_cell_volume   129.09079513
_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
  Br  Br0  1  2.62021312  0.00000000  4.59510170  1
  P  P1  1  0.00000000  0.00000000  0.90903486  1
  Tl  Tl2  1  2.62021312  0.00000000  1.46758967  1
  Tl  Tl3  1  0.00000000  0.00000000  6.29214548  1
[/CIF]
