data_[Y4Au8I24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Au  2.5400  1.3500  1.0700
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.3772]
_cell_length_b [14.6557]
_cell_length_c [7.8794]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.7344]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Y(AuI3)2]
_chemical_formula_sum '[Y4 Au8 I24]'
_cell_volume [1709.1860]
_cell_formula_units_Z [4]
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  4  0.0000  0.0722  0.7500  1
  Au  Au1  8  0.2335  0.4244  0.2816  1
  I  I2  8  0.1021  0.0873  0.1381  1
  I  I3  8  0.1336  0.4853  0.9520  1
  I  I4  8  0.1432  0.2069  0.7002  1
]