# generated using pymatgen
data_Li2HIO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65136900
_cell_length_b   6.67455300
_cell_length_c   10.49190800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2HIO
_chemical_formula_sum   'Li8 H4 I4 O4'
_cell_volume   395.75856692
_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
  Li  Li0  1  0.00022700  0.56081700  0.88932300  1
  Li  Li1  1  0.49977300  0.93918300  0.38932300  1
  Li  Li2  1  0.50022700  0.43918300  0.11067700  1
  Li  Li3  1  0.99977300  0.06081700  0.61067700  1
  Li  Li4  1  0.99977300  0.43918300  0.11067700  1
  Li  Li5  1  0.50022700  0.06081700  0.61067700  1
  Li  Li6  1  0.49977300  0.56081700  0.88932300  1
  Li  Li7  1  0.00022700  0.93918300  0.38932300  1
  H  H8  1  0.25000000  0.77415900  0.54419600  1
  H  H9  1  0.25000000  0.72584100  0.04419600  1
  H  H10  1  0.75000000  0.22584100  0.45580400  1
  H  H11  1  0.75000000  0.27415900  0.95580400  1
  I  I12  1  0.25000000  0.41599300  0.67470700  1
  I  I13  1  0.25000000  0.08400700  0.17470700  1
  I  I14  1  0.75000000  0.58400700  0.32529300  1
  I  I15  1  0.75000000  0.91599300  0.82529300  1
  O  O16  1  0.25000000  0.91597300  0.51884900  1
  O  O17  1  0.25000000  0.58402700  0.01884900  1
  O  O18  1  0.75000000  0.08402700  0.48115100  1
  O  O19  1  0.75000000  0.41597300  0.98115100  1
