# generated using pymatgen
data_IrRu(RhO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.49241644
_cell_length_b   4.49241603
_cell_length_c   9.31973802
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.05912120
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrRu(RhO3)4
_chemical_formula_sum   'Ir1 Ru1 Rh4 O12'
_cell_volume   188.08902242
_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
  Ir  Ir0  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru1  1  0.50000000  0.50000000  0.50000000  1.0
  Rh  Rh2  1  0.50000000  0.50000000  0.83227956  1.0
  Rh  Rh3  1  0.00000000  0.00000000  0.33411304  1.0
  Rh  Rh4  1  0.50000000  0.50000000  0.16772044  1.0
  Rh  Rh5  1  0.00000000  0.00000000  0.66588696  1.0
  O  O6  1  0.69111903  0.69111903  0.66449754  1.0
  O  O7  1  0.30888097  0.30888097  0.66449754  1.0
  O  O8  1  0.69111903  0.69111903  0.33550246  1.0
  O  O9  1  0.19190500  0.80809500  0.16659890  1.0
  O  O10  1  0.80809500  0.19190500  0.16659890  1.0
  O  O11  1  0.80809500  0.19190500  0.83340110  1.0
  O  O12  1  0.30438302  0.30438302  0.00000000  1.0
  O  O13  1  0.19850697  0.80149303  0.50000000  1.0
  O  O14  1  0.80149303  0.19850697  0.50000000  1.0
  O  O15  1  0.69561698  0.69561698  0.00000000  1.0
  O  O16  1  0.30888097  0.30888097  0.33550246  1.0
  O  O17  1  0.19190500  0.80809500  0.83340110  1.0