data_[U2Co4P4Ir2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Co  1.8800  1.3500  0.7683
  P  2.1900  1.0000  0.5500
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [3.6602]
_cell_length_b [7.9722]
_cell_length_c [5.8940]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [UCo2P2Ir]
_chemical_formula_sum '[U2 Co4 P4 Ir2]'
_cell_volume [171.9862]
_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
[
  U  U0  2  0.0000  0.4423  0.4668  1
  Co  Co1  2  0.0000  0.1542  0.8648  1
  Co  Co2  2  0.5000  0.0710  0.5429  1
  P  P3  2  0.0000  0.0931  0.2430  1
  P  P4  2  0.5000  0.2968  0.7661  1
  Ir  Ir5  2  0.5000  0.2673  0.1621  1
]