data_[Al2In4Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.5501]
_cell_length_b [5.9894]
_cell_length_c [13.4716]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Al(InPd4)2]
_chemical_formula_sum '[Al2 In4 Pd16]'
_cell_volume [367.1328]
_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
[
  Al  Al0  2  0.0000  0.5000  0.5000  1.0
  In  In1  4  0.0000  0.5000  0.1847  1.0
  Pd  Pd2  8  0.0000  0.2387  0.3599  1.0
  Pd  Pd3  4  0.0000  0.0000  0.1744  1.0
  Pd  Pd4  4  0.0000  0.2549  0.0000  1.0
]