data_[Zn4H4Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  H  2.2000  0.2500  0.0000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.7477]
_cell_length_b [3.2167]
_cell_length_c [10.1766]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.3517]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ZnHCl3]
_chemical_formula_sum '[Zn4 H4 Cl12]'
_cell_volume [505.4161]
_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
[
  Zn  Zn0  4  0.1541  0.5000  0.9440  1
  H  H1  4  0.1061  0.0000  0.4489  1
  Cl  Cl2  4  0.0619  0.0000  0.8362  1
  Cl  Cl3  4  0.1292  0.5000  0.4721  1
  Cl  Cl4  4  0.2106  0.0000  0.1284  1
]