[CIF]
data_BaCrIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.12116708
_cell_length_b   4.12116708
_cell_length_c   4.75892419
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaCrIr
_chemical_formula_sum   'Ba1 Cr1 Ir1'
_cell_volume   69.99707002
_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  -0.00000002  2.37935693  0.00517114  1
  Cr  Cr1  1  0.00000000  0.00000000  2.50940923  1
  Ir  Ir2  1  2.06058352  1.18967847  2.24434382  1
[/CIF]
