# generated using pymatgen
data_Ir2RuO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.49561737
_cell_length_b   4.49561737
_cell_length_c   9.47090103
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ir2RuO6
_chemical_formula_sum   'Ir4 Ru2 O12'
_cell_volume   191.41236112
_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
  Ir  Ir0  1  0.50000000  0.50000000  0.16719144  1.0
  Ir  Ir1  1  0.00000000  0.00000000  0.33280856  1.0
  Ir  Ir2  1  0.00000000  0.00000000  0.66719144  1.0
  Ir  Ir3  1  0.50000000  0.50000000  0.83280856  1.0
  Ru  Ru4  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru5  1  0.50000000  0.50000000  0.50000000  1.0
  O  O6  1  0.30568238  0.30568238  0.00000000  1.0
  O  O7  1  0.69431762  0.69431762  0.00000000  1.0
  O  O8  1  0.80915303  0.19084697  0.16523686  1.0
  O  O9  1  0.19084697  0.80915303  0.16523686  1.0
  O  O10  1  0.30915303  0.30915303  0.33476314  1.0
  O  O11  1  0.69084697  0.69084697  0.33476314  1.0
  O  O12  1  0.80568238  0.19431762  0.50000000  1.0
  O  O13  1  0.19431762  0.80568238  0.50000000  1.0
  O  O14  1  0.30915303  0.30915303  0.66523686  1.0
  O  O15  1  0.69084697  0.69084697  0.66523686  1.0
  O  O16  1  0.80915303  0.19084697  0.83476314  1.0
  O  O17  1  0.19084697  0.80915303  0.83476314  1.0