data_[Pd26Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [7.8907]
_cell_length_b [7.9342]
_cell_length_c [7.9240]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Pd13Pt3]
_chemical_formula_sum '[Pd26 Pt6]'
_cell_volume [496.0912]
_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
[
  Pd  Pd0  8  0.2499  0.2497  0.7501  1.0
  Pd  Pd1  4  0.0000  0.2496  0.4996  1.0
  Pd  Pd2  4  0.2497  0.0000  0.4991  1.0
  Pd  Pd3  4  0.5000  0.2494  0.0002  1.0
  Pd  Pd4  2  0.0000  0.0000  0.7511  1.0
  Pd  Pd5  2  0.5000  0.0000  0.2493  1.0
  Pd  Pd6  2  0.5000  0.0000  0.7515  1.0
  Pt  Pt7  4  0.2496  0.0000  0.0010  1.0
  Pt  Pt8  2  0.0000  0.0000  0.2480  1.0
]