data_[Al24H24Pt24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  H  2.2000  0.2500  0.0000
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pbcn]
_cell_length_a [9.4844]
_cell_length_b [5.5337]
_cell_length_c [17.6450]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [60]
_chemical_formula_structural [AlHPt]
_chemical_formula_sum '[Al24 H24 Pt24]'
_cell_volume [926.0683]
_cell_formula_units_Z [24]
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  8  0.2304  0.4958  0.5655  1
  Al  Al1  8  0.2372  0.4872  0.4021  1
  Al  Al2  8  0.2437  0.4911  0.2303  1
  H  H3  8  0.0440  0.4470  0.3173  1
  H  H4  8  0.0531  0.0300  0.0581  1
  H  H5  8  0.0558  0.0586  0.3112  1
  Pt  Pt6  8  0.0903  0.2212  0.4856  1
  Pt  Pt7  8  0.0910  0.2487  0.8160  1
  Pt  Pt8  8  0.0916  0.2320  0.1466  1
]