data_[Hf4Zn2B4Ir10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Zn  1.6500  1.3500  0.8800
  B  2.0400  0.8500  0.4100
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.2843]
_cell_length_b [9.2843]
_cell_length_c [3.2000]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Hf2ZnB2Ir5]
_chemical_formula_sum '[Hf4 Zn2 B4 Ir10]'
_cell_volume [275.8282]
_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
[
  Hf  Hf0  4  0.1768  0.6768  0.0000  1.0
  Zn  Zn1  2  0.0000  0.0000  0.0000  1.0
  B  B2  4  0.1239  0.3761  0.0000  1.0
  Ir  Ir3  8  0.0706  0.2164  0.5000  1.0
  Ir  Ir4  2  0.0000  0.5000  0.5000  1.0
]