# generated using pymatgen
data_K3LiIrO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.31945654
_cell_length_b   7.31945654
_cell_length_c   5.99232187
_cell_angle_alpha   79.66106138
_cell_angle_beta   79.66106138
_cell_angle_gamma   84.54074968
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K3LiIrO4
_chemical_formula_sum   'K6 Li2 Ir2 O8'
_cell_volume   310.03734636
_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
  K  K0  1  0.06571900  0.24368800  0.02606800  1
  K  K1  1  0.59479500  0.40520500  0.25000000  1
  K  K2  1  0.24368800  0.06571900  0.52606800  1
  K  K3  1  0.75631200  0.93428100  0.47393200  1
  K  K4  1  0.93428100  0.75631200  0.97393200  1
  K  K5  1  0.40520500  0.59479500  0.75000000  1
  Li  Li6  1  0.73182500  0.26817500  0.75000000  1
  Li  Li7  1  0.26817500  0.73182500  0.25000000  1
  Ir  Ir8  1  0.50000000  0.00000000  0.00000000  1
  Ir  Ir9  1  0.00000000  0.50000000  0.50000000  1
  O  O10  1  0.20369200  0.48053600  0.24626400  1
  O  O11  1  0.91318800  0.26508000  0.46986500  1
  O  O12  1  0.48053600  0.20369200  0.74626400  1
  O  O13  1  0.26508000  0.91318800  0.96986500  1
  O  O14  1  0.08681200  0.73492000  0.53013500  1
  O  O15  1  0.73492000  0.08681200  0.03013500  1
  O  O16  1  0.51946400  0.79630800  0.25373600  1
  O  O17  1  0.79630800  0.51946400  0.75373600  1
