# generated using pymatgen
data_Ba3TaRu2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.77959301
_cell_length_b   5.77950206
_cell_length_c   14.37455962
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00263109
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3TaRu2O9
_chemical_formula_sum   'Ba6 Ta2 Ru4 O18'
_cell_volume   415.81614268
_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  0.99997718  0.99998956  0.75000000  1.0
  Ba  Ba1  1  0.00002282  0.00001044  0.25000000  1.0
  Ba  Ba2  1  0.33332412  0.66666494  0.90644806  1.0
  Ba  Ba3  1  0.66667588  0.33333506  0.40644806  1.0
  Ba  Ba4  1  0.66667588  0.33333506  0.09355194  1.0
  Ba  Ba5  1  0.33332412  0.66666494  0.59355194  1.0
  Ta  Ta6  1  0.00000000  0.00000000  0.00000000  1.0
  Ta  Ta7  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru8  1  0.33334374  0.66666670  0.15913562  1.0
  Ru  Ru9  1  0.66665626  0.33333330  0.65913562  1.0
  Ru  Ru10  1  0.66665626  0.33333330  0.84086438  1.0
  Ru  Ru11  1  0.33334374  0.66666670  0.34086438  1.0
  O  O12  1  0.51466807  0.48524749  0.75000000  1.0
  O  O13  1  0.48533193  0.51475251  0.25000000  1.0
  O  O14  1  0.51471341  0.02947673  0.75000000  1.0
  O  O15  1  0.48528659  0.97052327  0.25000000  1.0
  O  O16  1  0.02947054  0.51474780  0.25000000  1.0
  O  O17  1  0.97052946  0.48525220  0.75000000  1.0
  O  O18  1  0.83656053  0.16344525  0.92109389  1.0
  O  O19  1  0.16343947  0.83655475  0.42109389  1.0
  O  O20  1  0.16343947  0.83655475  0.07890611  1.0
  O  O21  1  0.83656053  0.16344525  0.57890611  1.0
  O  O22  1  0.32689547  0.16344855  0.92109613  1.0
  O  O23  1  0.67310453  0.83655145  0.42109613  1.0
  O  O24  1  0.16344658  0.32689833  0.07890729  1.0
  O  O25  1  0.83655342  0.67310167  0.57890729  1.0
  O  O26  1  0.67310453  0.83655145  0.07890387  1.0
  O  O27  1  0.32689547  0.16344855  0.57890387  1.0
  O  O28  1  0.83655342  0.67310167  0.92109271  1.0
  O  O29  1  0.16344658  0.32689833  0.42109271  1.0