data_[Al4H8Cl24]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.4322]
_cell_length_b [12.5432]
_cell_length_c [5.9853]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2534]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Al(HCl3)2]
_chemical_formula_sum '[Al4 H8 Cl24]'
_cell_volume [1066.1900]
_cell_formula_units_Z [4]
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  0.0666  0.7500  1.0
  H  H1  8  0.1442  0.4769  0.3531  1.0
  Cl  Cl2  8  0.0777  0.2174  0.6629  1.0
  Cl  Cl3  8  0.0960  0.0549  0.1115  1.0
  Cl  Cl4  8  0.1442  0.4138  0.1798  1.0
]