# generated using pymatgen
data_Cu2Ir3RuO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.48707387
_cell_length_b   4.48707387
_cell_length_c   9.31774666
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.20778965
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2Ir3RuO12
_chemical_formula_sum   'Cu2 Ir3 Ru1 O12'
_cell_volume   187.60071120
_cell_formula_units_Z   1
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
  Cu  Cu0  1  0.00000000  0.00000000  0.99751660  1.0
  Cu  Cu1  1  0.50000000  0.50000000  0.50250650  1.0
  Ir  Ir2  1  0.50000000  0.50000000  0.83218470  1.0
  Ir  Ir3  1  0.00000000  0.00000000  0.33246359  1.0
  Ir  Ir4  1  0.50000000  0.50000000  0.16850599  1.0
  Ru  Ru5  1  0.00000000  0.00000000  0.66695534  1.0
  O  O6  1  0.69854414  0.69854414  0.66952935  1.0
  O  O7  1  0.30145586  0.30145586  0.66952935  1.0
  O  O8  1  0.69549201  0.69549201  0.33314465  1.0
  O  O9  1  0.19806013  0.80193987  0.16952646  1.0
  O  O10  1  0.80193987  0.19806013  0.16952646  1.0
  O  O11  1  0.80159496  0.19840504  0.82621974  1.0
  O  O12  1  0.30667990  0.30667990  0.99965571  1.0
  O  O13  1  0.18977162  0.81022838  0.50185773  1.0
  O  O14  1  0.81022838  0.18977162  0.50185773  1.0
  O  O15  1  0.69332010  0.69332010  0.99965571  1.0
  O  O16  1  0.30450799  0.30450799  0.33314465  1.0
  O  O17  1  0.19840504  0.80159496  0.82621974  1.0