# generated using pymatgen
data_Hg3(ClO5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.64909098
_cell_length_b   9.64909098
_cell_length_c   11.48580405
_cell_angle_alpha   86.64743132
_cell_angle_beta   86.64743132
_cell_angle_gamma   31.17337011
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hg3(ClO5)2
_chemical_formula_sum   'Hg6 Cl4 O20'
_cell_volume   552.52412976
_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
  Hg  Hg0  1  0.08751300  0.05177600  0.98498100  1.0
  Hg  Hg1  1  0.94822400  0.91248700  0.51501900  1.0
  Hg  Hg2  1  0.91248700  0.94822400  0.01501900  1.0
  Hg  Hg3  1  0.05177600  0.08751300  0.48498100  1.0
  Hg  Hg4  1  0.00000000  0.50000000  0.00000000  1.0
  Hg  Hg5  1  0.50000000  0.00000000  0.50000000  1.0
  Cl  Cl6  1  0.55749000  0.69829900  0.22896000  1.0
  Cl  Cl7  1  0.30170100  0.44251000  0.27104000  1.0
  Cl  Cl8  1  0.44251000  0.30170100  0.77104000  1.0
  Cl  Cl9  1  0.69829900  0.55749000  0.72896000  1.0
  O  O10  1  0.78548100  0.84645500  0.03809000  1.0
  O  O11  1  0.15354500  0.21451900  0.46191000  1.0
  O  O12  1  0.21451900  0.15354500  0.96191000  1.0
  O  O13  1  0.84645500  0.78548100  0.53809000  1.0
  O  O14  1  0.70649000  0.69336900  0.25938700  1.0
  O  O15  1  0.30663100  0.29351000  0.24061300  1.0
  O  O16  1  0.29351000  0.30663100  0.74061300  1.0
  O  O17  1  0.69336900  0.70649000  0.75938700  1.0
  O  O18  1  0.27089500  0.97636500  0.22114300  1.0
  O  O19  1  0.02363500  0.72910500  0.27885700  1.0
  O  O20  1  0.72910500  0.02363500  0.77885700  1.0
  O  O21  1  0.97636500  0.27089500  0.72114300  1.0
  O  O22  1  0.59244700  0.55680100  0.31941100  1.0
  O  O23  1  0.44319900  0.40755300  0.18058900  1.0
  O  O24  1  0.40755300  0.44319900  0.68058900  1.0
  O  O25  1  0.55680100  0.59244700  0.81941100  1.0
  O  O26  1  0.65182400  0.57290600  0.11578900  1.0
  O  O27  1  0.42709400  0.34817600  0.38421100  1.0
  O  O28  1  0.34817600  0.42709400  0.88421100  1.0
  O  O29  1  0.57290600  0.65182400  0.61578900  1.0