# generated using pymatgen
data_Ba2PrIrO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.03839495
_cell_length_b   6.03469015
_cell_length_c   8.59674804
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.99983727
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2PrIrO6
_chemical_formula_sum   'Ba4 Pr2 Ir2 O12'
_cell_volume   313.26414486
_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
  Ba  Ba0  1  0.50000000  -0.00000000  0.24941412  1.0
  Ba  Ba1  1  0.50000000  -0.00000000  0.75058588  1.0
  Ba  Ba2  1  -0.00000000  0.50000000  0.74970435  1.0
  Ba  Ba3  1  -0.00000000  0.50000000  0.25029565  1.0
  Pr  Pr4  1  0.50000000  0.50000000  0.00000000  1.0
  Pr  Pr5  1  -0.00000000  -0.00000000  0.50000000  1.0
  Ir  Ir6  1  0.50000000  0.50000000  0.50000000  1.0
  Ir  Ir7  1  -0.00000000  -0.00000000  0.00000000  1.0
  O  O8  1  0.78759177  0.23878807  0.00000000  1.0
  O  O9  1  0.50000000  0.50000000  0.26892747  1.0
  O  O10  1  -0.00000000  -0.00000000  0.76895234  1.0
  O  O11  1  0.21240823  0.76121193  0.00000000  1.0
  O  O12  1  0.71315058  0.73801328  0.50000000  1.0
  O  O13  1  0.28684942  0.26198672  0.50000000  1.0
  O  O14  1  -0.00000000  -0.00000000  0.23104766  1.0
  O  O15  1  0.50000000  0.50000000  0.73107253  1.0
  O  O16  1  0.25559029  0.71894648  0.50000000  1.0
  O  O17  1  0.74440971  0.28105352  0.50000000  1.0
  O  O18  1  0.75469813  0.78192308  0.00000000  1.0
  O  O19  1  0.24530187  0.21807692  0.00000000  1.0