data_[Co13Ir2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.3881]
_cell_length_b [5.6744]
_cell_length_c [7.5860]
_cell_angle_alpha [72.5231]
_cell_angle_beta [73.4682]
_cell_angle_gamma [82.7692]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Co13Ir2]
_chemical_formula_sum '[Co13 Ir2]'
_cell_volume [172.5537]
_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
[
  Co  Co0  2  0.0679  0.3965  0.7430  1
  Co  Co1  2  0.2032  0.2056  0.1913  1
  Co  Co2  2  0.2675  0.6002  0.9346  1
  Co  Co3  2  0.3335  0.9970  0.6752  1
  Co  Co4  2  0.4062  0.3998  0.3929  1
  Co  Co5  2  0.4695  0.8001  0.1275  1
  Co  Co6  1  0.0000  0.0000  0.0000  1
  Ir  Ir7  2  0.1367  0.7949  0.4649  1
]