data_[H2Pd12Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.0756]
_cell_length_b [2.7217]
_cell_length_c [12.0100]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.8504]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [H(Pd2Pt)3]
_chemical_formula_sum '[H2 Pd12 Pt6]'
_cell_volume [290.3364]
_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  2  0.0107  0.7500  0.6048  1
  H  H1  2  0.0196  0.2500  0.7261  1
  Pd  Pd2  2  0.0943  0.7500  0.8412  1
  Pd  Pd3  2  0.1892  0.7500  0.2628  1
  Pd  Pd4  2  0.3089  0.7500  0.7195  1
  Pd  Pd5  2  0.4111  0.2500  0.1707  1
  Pd  Pd6  2  0.4880  0.7500  0.3904  1
  Pt  Pt7  2  0.1356  0.2500  0.0472  1
  Pt  Pt8  2  0.2525  0.7500  0.4940  1
  Pt  Pt9  2  0.3739  0.2500  0.9347  1
]