data_[Y2Al4Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Al  1.6100  1.2500  0.6750
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.4080]
_cell_length_b [11.3084]
_cell_length_c [4.6687]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.8956]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Y(AlPd4)2]
_chemical_formula_sum '[Y2 Al4 Pd16]'
_cell_volume [367.7629]
_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  0.0000  0.5000  1
  Al  Al1  4  0.0000  0.3129  0.0000  1
  Pd  Pd2  8  0.2026  0.1233  0.1043  1
  Pd  Pd3  4  0.0000  0.2430  0.5000  1
  Pd  Pd4  4  0.0982  0.5000  0.3092  1
]