data_[Y10In4Hg2Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [11.8668]
_cell_length_b [11.8668]
_cell_length_c [3.6956]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Y5In2HgIr2]
_chemical_formula_sum '[Y10 In4 Hg2 Ir4]'
_cell_volume [520.4182]
_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
[
  Y  Y0  8  0.0756  0.2050  0.5000  1.0
  Y  Y1  2  0.0000  0.5000  0.5000  1.0
  In  In2  4  0.1746  0.6746  0.0000  1.0
  Hg  Hg3  2  0.0000  0.0000  0.0000  1.0
  Ir  Ir4  4  0.1329  0.3671  0.0000  1.0
]