[CIF]
data_Cr2IrBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.87447702
_cell_length_b   2.87447702
_cell_length_c   6.63015737
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2IrBr
_chemical_formula_sum   'Cr2 Ir1 Br1'
_cell_volume   54.78245840
_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  0.00000000  0.00000000  0.00000000  1
  Cr  Cr1  1  1.43723851  1.43723851  1.61182083  1
  Cr  Cr2  1  1.43723851  1.43723851  5.01833654  1
  Ir  Ir3  1  0.00000000  0.00000000  3.31507869  1
[/CIF]
