# generated using pymatgen
data_Ba(IrO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.20110184
_cell_length_b   8.20110159
_cell_length_c   8.20110173
_cell_angle_alpha   109.57777626
_cell_angle_beta   109.57777736
_cell_angle_gamma   109.57777859
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba(IrO3)2
_chemical_formula_sum   'Ba3 Ir6 O18'
_cell_volume   422.93092172
_cell_formula_units_Z   3
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
  Ba  Ba0  1  0.36210193  0.99702007  0.99404109  1.0
  Ba  Ba1  1  0.99702007  0.99404109  0.36210193  1.0
  Ba  Ba2  1  0.99404109  0.36210193  0.99702007  1.0
  Ir  Ir3  1  0.50140540  0.34550645  0.83828791  1.0
  Ir  Ir4  1  0.83828791  0.50140540  0.34550645  1.0
  Ir  Ir5  1  0.34550645  0.83828791  0.50140540  1.0
  Ir  Ir6  1  0.65561793  0.16190113  0.50105829  1.0
  Ir  Ir7  1  0.16190113  0.50105829  0.65561793  1.0
  Ir  Ir8  1  0.50105829  0.65561793  0.16190113  1.0
  O  O9  1  0.64195591  0.63938573  0.00996280  1.0
  O  O10  1  0.71747130  0.66754059  0.36439053  1.0
  O  O11  1  0.66754059  0.36439053  0.71747130  1.0
  O  O12  1  0.68459680  0.32850953  0.04893599  1.0
  O  O13  1  0.32850953  0.04893599  0.68459680  1.0
  O  O14  1  0.64276387  0.30199161  0.35407299  1.0
  O  O15  1  0.04893599  0.68459680  0.32850953  1.0
  O  O16  1  0.99735976  0.35907022  0.35650509  1.0
  O  O17  1  0.35650509  0.99735976  0.35907022  1.0
  O  O18  1  0.00996280  0.64195591  0.63938573  1.0
  O  O19  1  0.94951452  0.28384386  0.63988070  1.0
  O  O20  1  0.36439053  0.71747130  0.66754059  1.0
  O  O21  1  0.63988070  0.94951452  0.28384386  1.0
  O  O22  1  0.28384386  0.63988070  0.94951452  1.0
  O  O23  1  0.63938573  0.00996280  0.64195591  1.0
  O  O24  1  0.35407299  0.64276387  0.30199161  1.0
  O  O25  1  0.30199161  0.35407299  0.64276387  1.0
  O  O26  1  0.35907022  0.35650509  0.99735976  1.0