# generated using pymatgen
data_NaIrO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30027151
_cell_length_b   5.30027151
_cell_length_c   7.16173793
_cell_angle_alpha   89.99755849
_cell_angle_beta   90.00244151
_cell_angle_gamma   146.25104545
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaIrO3
_chemical_formula_sum   'Na2 Ir2 O6'
_cell_volume   111.77425064
_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
  Na  Na0  1  0.74842314  0.25157686  0.24999073  1.0
  Na  Na1  1  0.25157472  0.74842528  0.75000997  1.0
  Ir  Ir2  1  0.00000458  -0.00000458  0.50001484  1.0
  Ir  Ir3  1  0.00000172  -0.00000172  -0.00001679  1.0
  O  O4  1  0.07461074  0.92538926  0.25000123  1.0
  O  O5  1  0.92539197  0.07460803  0.74999961  1.0
  O  O6  1  0.38409046  0.61590954  0.44041910  1.0
  O  O7  1  0.61590658  0.38409342  0.55959189  1.0
  O  O8  1  0.38409107  0.61590893  0.05957460  1.0
  O  O9  1  0.61590601  0.38409399  0.94041582  1.0