data_[H4Cl5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  H  2.2000  0.2500  0.0000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [7.8223]
_cell_length_b [15.0000]
_cell_length_c [7.8570]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.4491]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [H4Cl5]
_chemical_formula_sum '[H4 Cl5]'
_cell_volume [911.8876]
_cell_formula_units_Z [1]
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
[
  H  H0  1  0.0788  0.5000  0.1345  1
  H  H1  1  0.3866  0.5000  0.3006  1
  H  H2  1  0.6175  0.5000  0.5423  1
  H  H3  1  0.6419  0.5000  0.6571  1
  Cl  Cl4  1  0.0462  0.5000  0.8566  1
  Cl  Cl5  1  0.1175  0.5000  0.3040  1
  Cl  Cl6  1  0.3098  0.5000  0.8558  1
  Cl  Cl7  1  0.5553  0.5000  0.2914  1
  Cl  Cl8  1  0.6750  0.5000  0.8672  1
]