# generated using pymatgen
data_Li2IO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.49260298
_cell_length_b   5.49260298
_cell_length_c   28.78043900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001184
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2IO6
_chemical_formula_sum   'Li12 I6 O36'
_cell_volume   751.94211719
_cell_formula_units_Z   6
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  0.31943700  0.60022500  0.99860000  1
  Li  Li1  1  0.28078800  0.68056300  0.66526700  1
  Li  Li2  1  0.68056300  0.39977500  0.49860000  1
  Li  Li3  1  0.39977500  0.71921200  0.33193400  1
  Li  Li4  1  0.71921200  0.31943700  0.16526700  1
  Li  Li5  1  0.60022500  0.28078800  0.83193400  1
  Li  Li6  1  0.65309700  0.26809400  0.99616600  1
  Li  Li7  1  0.61499700  0.34690300  0.66283200  1
  Li  Li8  1  0.34690300  0.73190600  0.49616600  1
  Li  Li9  1  0.73190600  0.38500300  0.32949900  1
  Li  Li10  1  0.38500300  0.65309700  0.16283200  1
  Li  Li11  1  0.26809400  0.61499700  0.82949900  1
  I  I12  1  0.93513400  0.94883500  0.82867900  1
  I  I13  1  0.01370100  0.06486600  0.49534500  1
  I  I14  1  0.06486600  0.05116500  0.32867900  1
  I  I15  1  0.05116500  0.98629900  0.16201200  1
  I  I16  1  0.98629900  0.93513400  0.99534500  1
  I  I17  1  0.94883500  0.01370100  0.66201200  1
  O  O18  1  0.91229300  0.22886600  0.86301900  1
  O  O19  1  0.31657300  0.08770700  0.52968500  1
  O  O20  1  0.08770700  0.77113400  0.36301900  1
  O  O21  1  0.77113400  0.68342700  0.19635200  1
  O  O22  1  0.68342700  0.91229300  0.02968500  1
  O  O23  1  0.22886600  0.31657300  0.69635200  1
  O  O24  1  0.65239600  0.64690500  0.86303100  1
  O  O25  1  0.99450900  0.34760400  0.52969800  1
  O  O26  1  0.34760400  0.35309500  0.36303100  1
  O  O27  1  0.35309500  0.00549100  0.19636500  1
  O  O28  1  0.00549100  0.65239600  0.02969800  1
  O  O29  1  0.64690500  0.99450900  0.69636500  1
  O  O30  1  0.73205600  0.76462000  0.52997500  1
  O  O31  1  0.03256400  0.26794400  0.19664200  1
  O  O32  1  0.26794400  0.23538000  0.02997500  1
  O  O33  1  0.23538000  0.96743600  0.86330900  1
  O  O34  1  0.96743600  0.73205600  0.69664200  1
  O  O35  1  0.76462000  0.03256400  0.36330900  1
  O  O36  1  0.64561300  0.73327900  0.62781400  1
  O  O37  1  0.08766700  0.35438700  0.29448100  1
  O  O38  1  0.35438700  0.26672100  0.12781400  1
  O  O39  1  0.26672100  0.91233300  0.96114700  1
  O  O40  1  0.91233300  0.64561300  0.79448100  1
  O  O41  1  0.73327900  0.08766700  0.46114700  1
  O  O42  1  0.65467700  0.97021300  0.79428100  1
  O  O43  1  0.31553700  0.34532300  0.46094800  1
  O  O44  1  0.34532300  0.02978700  0.29428100  1
  O  O45  1  0.02978700  0.68446300  0.12761500  1
  O  O46  1  0.68446300  0.65467700  0.96094800  1
  O  O47  1  0.97021300  0.31553700  0.62761500  1
  O  O48  1  0.00957000  0.23874600  0.96143400  1
  O  O49  1  0.22917700  0.99043000  0.62810100  1
  O  O50  1  0.99043000  0.76125400  0.46143400  1
  O  O51  1  0.76125400  0.77082300  0.29476800  1
  O  O52  1  0.77082300  0.00957000  0.12810100  1
  O  O53  1  0.23874600  0.22917700  0.79476800  1
