data_[Li2Zn4Ir2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  Ir  2.2000  1.3500  0.7650
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.3083]
_cell_length_b [5.1296]
_cell_length_c [9.3719]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.1359]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [LiZn2IrO6]
_chemical_formula_sum '[Li2 Zn4 Ir2 O12]'
_cell_volume [216.0947]
_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  2  0.0000  0.0000  0.5000  1.0
  Zn  Zn1  4  0.2039  0.0208  0.2294  1.0
  Ir  Ir2  2  0.5000  0.0000  0.0000  1.0
  O  O3  4  0.1667  0.1062  0.7757  1.0
  O  O4  4  0.2206  0.6593  0.5451  1.0
  O  O5  4  0.4547  0.1827  0.5871  1.0
]