data_[Li2Pr4Ir2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pr  1.1300  1.8500  1.0600
  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 [5.4759]
_cell_length_b [5.8237]
_cell_length_c [9.5084]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.6637]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [LiPr2IrO6]
_chemical_formula_sum '[Li2 Pr4 Ir2 O12]'
_cell_volume [249.4058]
_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  0.0000  1.0
  Pr  Pr1  4  0.2315  0.0706  0.7482  1.0
  Ir  Ir2  2  0.5000  0.0000  0.5000  1.0
  O  O3  4  0.1572  0.1900  0.4538  1.0
  O  O4  4  0.2669  0.7132  0.4497  1.0
  O  O5  4  0.3464  0.0260  0.2540  1.0
]