data_[Al6Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [3.4429]
_cell_length_b [8.1876]
_cell_length_c [4.8863]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.4861]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Al3Pd]
_chemical_formula_sum '[Al6 Pd2]'
_cell_volume [130.6322]
_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  4  0.1407  0.0376  0.2730  1.0
  Al  Al1  2  0.4159  0.2500  0.8952  1.0
  Pd  Pd2  2  0.2820  0.7500  0.5377  1.0
]