data_[Y2In4Au16]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.1260]
_cell_length_b [4.3385]
_cell_length_c [6.8804]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.6155]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Y(InAu4)2]
_chemical_formula_sum '[Y2 In4 Au16]'
_cell_volume [436.9016]
_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  2  0.0000  0.5000  0.0000  1.0
  In  In1  4  0.2255  0.0000  0.6591  1.0
  Au  Au2  4  0.0425  0.0000  0.7244  1.0
  Au  Au3  4  0.0949  0.5000  0.4603  1.0
  Au  Au4  4  0.1358  0.0000  0.1893  1.0
  Au  Au5  4  0.1821  0.5000  0.9055  1.0
]