# generated using pymatgen
data_Ba3GdIrRuO9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.97676447
_cell_length_b   5.97676447
_cell_length_c   14.82660100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000521
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3GdIrRuO9
_chemical_formula_sum   'Ba6 Gd2 Ir2 Ru2 O18'
_cell_volume   458.67439069
_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  0.66666700  0.33333300  0.40318200  1.0
  Ba  Ba1  1  0.33333300  0.66666700  0.59764500  1.0
  Ba  Ba2  1  0.33333300  0.66666700  0.90318200  1.0
  Ba  Ba3  1  0.66666700  0.33333300  0.09764500  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.74991300  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.24991300  1.0
  Gd  Gd6  1  0.00000000  0.00000000  0.50115200  1.0
  Gd  Gd7  1  0.00000000  0.00000000  0.00115200  1.0
  Ir  Ir8  1  0.66666700  0.33333300  0.66525700  1.0
  Ir  Ir9  1  0.33333300  0.66666700  0.16525700  1.0
  Ru  Ru10  1  0.33333300  0.66666700  0.33597100  1.0
  Ru  Ru11  1  0.66666700  0.33333300  0.83597100  1.0
  O  O12  1  0.51026700  0.02053400  0.75055600  1.0
  O  O13  1  0.51026700  0.48973300  0.75055600  1.0
  O  O14  1  0.97946600  0.48973300  0.75055600  1.0
  O  O15  1  0.48973300  0.97946600  0.25055600  1.0
  O  O16  1  0.48973300  0.51026700  0.25055600  1.0
  O  O17  1  0.02053400  0.51026700  0.25055600  1.0
  O  O18  1  0.82334100  0.64668200  0.90990700  1.0
  O  O19  1  0.82334100  0.17665900  0.90990700  1.0
  O  O20  1  0.35331800  0.17665900  0.90990700  1.0
  O  O21  1  0.17630700  0.35261300  0.08840700  1.0
  O  O22  1  0.17630700  0.82369300  0.08840700  1.0
  O  O23  1  0.64738700  0.82369300  0.08840700  1.0
  O  O24  1  0.17665900  0.35331800  0.40990700  1.0
  O  O25  1  0.17665900  0.82334100  0.40990700  1.0
  O  O26  1  0.64668200  0.82334100  0.40990700  1.0
  O  O27  1  0.82369300  0.64738700  0.58840700  1.0
  O  O28  1  0.82369300  0.17630700  0.58840700  1.0
  O  O29  1  0.35261300  0.17630700  0.58840700  1.0