data_[Al6Pd4Pt6]
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
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.3685]
_cell_length_b [4.2129]
_cell_length_c [16.7542]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Al3Pd2Pt3]
_chemical_formula_sum '[Al6 Pd4 Pt6]'
_cell_volume [237.7634]
_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  0.0000  0.0000  0.1310  1
  Al  Al1  2  0.0000  0.5000  0.0000  1
  Pd  Pd2  4  0.0000  0.5000  0.2599  1
  Pt  Pt3  4  0.0000  0.0000  0.3839  1
  Pt  Pt4  2  0.0000  0.5000  0.5000  1
]