data_[Ce12Co2Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Co  1.8800  1.3500  0.7683
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.2655]
_cell_length_b [7.2431]
_cell_length_c [11.3446]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.3577]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ce6CoIr2]
_chemical_formula_sum '[Ce12 Co2 Ir4]'
_cell_volume [439.6331]
_cell_formula_units_Z [2]
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
[
  Ce  Ce0  4  0.0937  0.1929  0.4353  1.0
  Ce  Ce1  4  0.2979  0.6590  0.4483  1.0
  Ce  Ce2  4  0.3932  0.0396  0.2458  1.0
  Co  Co3  2  0.5000  0.0000  0.5000  1.0
  Ir  Ir4  4  0.1575  0.1192  0.7243  1.0
]