# generated using pymatgen
data_Ba3NiIrRuO9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82303591
_cell_length_b   5.82303591
_cell_length_c   14.28048700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999899
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3NiIrRuO9
_chemical_formula_sum   'Ba6 Ni2 Ir2 Ru2 O18'
_cell_volume   419.34608341
_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  0.33333300  0.66666700  0.58749100  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.41250900  1.0
  Ba  Ba2  1  0.66666700  0.33333300  0.08670300  1.0
  Ba  Ba3  1  0.33333300  0.66666700  0.91329700  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.24948300  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.75051700  1.0
  Ni  Ni6  1  0.00000000  0.00000000  0.50000000  1.0
  Ni  Ni7  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir8  1  0.66666700  0.33333300  0.84017900  1.0
  Ir  Ir9  1  0.33333300  0.66666700  0.15982100  1.0
  Ru  Ru10  1  0.33333300  0.66666700  0.34232100  1.0
  Ru  Ru11  1  0.66666700  0.33333300  0.65767900  1.0
  O  O12  1  0.48859100  0.51140900  0.25011900  1.0
  O  O13  1  0.48859100  0.97718100  0.25011900  1.0
  O  O14  1  0.02281900  0.51140900  0.25011900  1.0
  O  O15  1  0.51140900  0.48859100  0.74988100  1.0
  O  O16  1  0.51140900  0.02281900  0.74988100  1.0
  O  O17  1  0.97718100  0.48859100  0.74988100  1.0
  O  O18  1  0.17092100  0.82907900  0.08409800  1.0
  O  O19  1  0.17092100  0.34184100  0.08409800  1.0
  O  O20  1  0.65815900  0.82907900  0.08409800  1.0
  O  O21  1  0.82907900  0.17092100  0.91590200  1.0
  O  O22  1  0.82907900  0.65815900  0.91590200  1.0
  O  O23  1  0.34184100  0.17092100  0.91590200  1.0
  O  O24  1  0.82898000  0.17102000  0.58430000  1.0
  O  O25  1  0.82898000  0.65796100  0.58430000  1.0
  O  O26  1  0.34203900  0.17102000  0.58430000  1.0
  O  O27  1  0.17102000  0.82898000  0.41570000  1.0
  O  O28  1  0.17102000  0.34203900  0.41570000  1.0
  O  O29  1  0.65796100  0.82898000  0.41570000  1.0