data_[Ba2Y2Al8Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  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 [Amm2]
_cell_length_a [7.3757]
_cell_length_b [4.2425]
_cell_length_c [11.1140]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [BaY(Al2Pd)2]
_chemical_formula_sum '[Ba2 Y2 Al8 Pd4]'
_cell_volume [347.7739]
_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
[
  Ba  Ba0  2  0.0000  0.0000  0.5522  1
  Y  Y1  2  0.5000  0.0000  0.4456  1
  Al  Al2  4  0.2031  0.0000  0.8316  1
  Al  Al3  4  0.3169  0.0000  0.1711  1
  Pd  Pd4  2  0.0000  0.0000  0.2798  1
  Pd  Pd5  2  0.5000  0.0000  0.7170  1
]