data_[Na24Al8H48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Al  1.6100  1.2500  0.6750
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Pbcm]
_cell_length_a [5.2917]
_cell_length_b [8.8366]
_cell_length_c [17.2305]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [57]
_chemical_formula_structural [Na3AlH6]
_chemical_formula_sum '[Na24 Al8 H48]'
_cell_volume [805.7057]
_cell_formula_units_Z [8]
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
[
  Na  Na0  8  0.1872  0.7498  0.6650  1
  Na  Na1  8  0.2587  0.0834  0.5520  1
  Na  Na2  8  0.3040  0.0907  0.1529  1
  Al  Al3  4  0.2174  0.7500  0.0000  1
  Al  Al4  4  0.2588  0.0778  0.7500  1
  H  H5  8  0.0267  0.1847  0.0611  1
  H  H6  8  0.0484  0.0268  0.6771  1
  H  H7  8  0.2226  0.5843  0.5520  1
  H  H8  8  0.4459  0.6710  0.0616  1
  H  H9  8  0.4659  0.1279  0.6760  1
  H  H10  4  0.1338  0.2373  0.2500  1
  H  H11  4  0.3891  0.6043  0.2500  1
]