[CIF]
data_BaTl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.26110784
_cell_length_b   6.26110784
_cell_length_c   9.70606432
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaTl
_chemical_formula_sum   'Ba4 Tl4'
_cell_volume   329.51574003
_cell_formula_units_Z   4
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
  Ba  Ba0  1  0.00000000  0.00000000  2.42651608  1
  Ba  Ba1  1  0.00000000  0.00000000  7.27954824  1
  Ba  Ba2  1  3.13055392  1.80742615  7.27954824  1
  Ba  Ba3  1  0.00000000  3.61485230  2.42651608  1
  Tl  Tl4  1  3.13055392  1.80742615  0.89906352  1
  Tl  Tl5  1  -0.00000000  3.61485230  5.75209568  1
  Tl  Tl6  1  0.00000000  3.61485230  8.80700080  1
  Tl  Tl7  1  3.13055392  1.80742615  3.95396864  1
[/CIF]
