[CIF]
data_BaBrCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.07910659
_cell_length_b   4.07910659
_cell_length_c   7.46745072
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaBrCl2
_chemical_formula_sum   'Ba1 Br1 Cl2'
_cell_volume   124.25173823
_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
  Ba  Ba0  1  0.00000000  0.00000000  3.73372536  1
  Br  Br1  1  0.00000000  0.00000000  0.00000000  1
  Cl  Cl2  1  2.03955330  2.03955330  2.20492418  1
  Cl  Cl3  1  2.03955330  2.03955330  5.26252654  1
[/CIF]
