# generated using pymatgen
data_LiIO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.08059300
_cell_length_b   5.49114600
_cell_length_c   15.60032313
_cell_angle_alpha   69.53167603
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiIO5
_chemical_formula_sum   'Li4 I4 O20'
_cell_volume   407.74468654
_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  0.53462500  0.71681000  0.27841400  1
  Li  Li1  1  0.96537500  0.71681000  0.77841400  1
  Li  Li2  1  0.46537500  0.28319000  0.72158600  1
  Li  Li3  1  0.03462500  0.28319000  0.22158600  1
  I  I4  1  0.52961100  0.10691700  0.39375000  1
  I  I5  1  0.97038900  0.10691700  0.89375000  1
  I  I6  1  0.47038900  0.89308300  0.60625000  1
  I  I7  1  0.02961100  0.89308300  0.10625000  1
  O  O8  1  0.70456600  0.86675000  0.50611000  1
  O  O9  1  0.79543400  0.86675000  0.00611000  1
  O  O10  1  0.29543400  0.13325000  0.49389000  1
  O  O11  1  0.20456600  0.13325000  0.99389000  1
  O  O12  1  0.33246900  0.83851300  0.37806500  1
  O  O13  1  0.16753100  0.83851300  0.87806500  1
  O  O14  1  0.66753100  0.16148700  0.62193500  1
  O  O15  1  0.83246900  0.16148700  0.12193500  1
  O  O16  1  0.32440600  0.34726000  0.30695700  1
  O  O17  1  0.17559400  0.34726000  0.80695700  1
  O  O18  1  0.67559400  0.65274000  0.69304300  1
  O  O19  1  0.82440600  0.65274000  0.19304300  1
  O  O20  1  0.73469900  0.39029200  0.39219000  1
  O  O21  1  0.76530100  0.39029200  0.89219000  1
  O  O22  1  0.26530100  0.60970800  0.60781000  1
  O  O23  1  0.23469900  0.60970800  0.10781000  1
  O  O24  1  0.77857700  0.03137400  0.31964400  1
  O  O25  1  0.72142300  0.03137400  0.81964400  1
  O  O26  1  0.22142300  0.96862600  0.68035600  1
  O  O27  1  0.27857700  0.96862600  0.18035600  1
