data_[Zn4H2O8]
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
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2852]
_cell_length_b [5.9824]
_cell_length_c [6.2042]
_cell_angle_alpha [106.5595]
_cell_angle_beta [102.0519]
_cell_angle_gamma [113.6630]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Zn2HO4]
_chemical_formula_sum '[Zn4 H2 O8]'
_cell_volume [160.1265]
_cell_formula_units_Z [2]
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  1  0.3270  0.8696  0.0681  1
  Zn  Zn1  1  0.3581  0.2871  0.8340  1
  Zn  Zn2  1  0.5524  0.8860  0.6454  1
  Zn  Zn3  1  0.9976  0.3304  0.1403  1
  H  H4  1  0.0207  0.6731  0.5109  1
  H  H5  1  0.6901  0.5791  0.6780  1
  O  O6  1  0.0102  0.9731  0.0415  1
  O  O7  1  0.1491  0.6678  0.4193  1
  O  O8  1  0.2132  0.5038  0.9630  1
  O  O9  1  0.5181  0.3863  0.5819  1
  O  O10  1  0.5659  0.1204  0.9445  1
  O  O11  1  0.6515  0.0338  0.3991  1
  O  O12  1  0.7667  0.3002  0.5034  1
  O  O13  1  0.9294  0.8894  0.7704  1
]