data_[Y16In4Bi4]
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
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.0064]
_cell_length_b [13.9649]
_cell_length_c [6.3211]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.4729]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Y4InBi]
_chemical_formula_sum '[Y16 In4 Bi4]'
_cell_volume [723.6074]
_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  8  0.1059  0.1892  0.5672  1
  Y  Y1  8  0.2029  0.4139  0.8326  1
  In  In2  4  0.0000  0.0013  0.2500  1
  Bi  Bi3  4  0.0000  0.3842  0.2500  1
]