# generated using pymatgen
data_LiBi3(IO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.36508178
_cell_length_b   7.36508178
_cell_length_c   11.26355800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   134.97182033
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBi3(IO2)2
_chemical_formula_sum   'Li2 Bi6 I4 O8'
_cell_volume   432.24426749
_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
  Li  Li0  1  0.20948300  0.79051700  0.75000000  1
  Li  Li1  1  0.79051700  0.20948300  0.25000000  1
  Bi  Bi2  1  0.83818000  0.16182000  0.75000000  1
  Bi  Bi3  1  0.33286800  0.66713200  0.00262600  1
  Bi  Bi4  1  0.66713200  0.33286800  0.99737400  1
  Bi  Bi5  1  0.16182000  0.83818000  0.25000000  1
  Bi  Bi6  1  0.33286800  0.66713200  0.49737400  1
  Bi  Bi7  1  0.66713200  0.33286800  0.50262600  1
  I  I8  1  0.49228400  0.50771600  0.75000000  1
  I  I9  1  0.00000000  0.00000000  0.00000000  1
  I  I10  1  0.50771600  0.49228400  0.25000000  1
  I  I11  1  0.00000000  0.00000000  0.50000000  1
  O  O12  1  0.00055800  0.49270800  0.87651800  1
  O  O13  1  0.50729200  0.99944200  0.87651800  1
  O  O14  1  0.99944200  0.50729200  0.12348200  1
  O  O15  1  0.49270800  0.00055800  0.12348200  1
  O  O16  1  0.99944200  0.50729200  0.37651800  1
  O  O17  1  0.00055800  0.49270800  0.62348200  1
  O  O18  1  0.49270800  0.00055800  0.37651800  1
  O  O19  1  0.50729200  0.99944200  0.62348200  1
