# generated using pymatgen
data_Ba3NiRu2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76736324
_cell_length_b   5.76736324
_cell_length_c   14.14538841
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000206
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3NiRu2O9
_chemical_formula_sum   'Ba6 Ni2 Ru4 O18'
_cell_volume   407.47419421
_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  0.41052777  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.91052177  1.0
  Ba  Ba2  1  0.66666700  0.33333300  0.58969290  1.0
  Ba  Ba3  1  0.33333300  0.66666700  0.08968588  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.75006118  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.25006389  1.0
  Ni  Ni6  1  0.00000000  0.00000000  0.50004418  1.0
  Ni  Ni7  1  0.00000000  0.00000000  0.00004265  1.0
  Ru  Ru8  1  0.33333300  0.66666700  0.65302211  1.0
  Ru  Ru9  1  0.66666700  0.33333300  0.15301826  1.0
  Ru  Ru10  1  0.66666700  0.33333300  0.34701383  1.0
  Ru  Ru11  1  0.33333300  0.66666700  0.84700606  1.0
  O  O12  1  0.82994573  0.17005427  0.41777029  1.0
  O  O13  1  0.82994573  0.65989047  0.41777029  1.0
  O  O14  1  0.34010953  0.17005427  0.41777029  1.0
  O  O15  1  0.65989358  0.82994729  0.91776522  1.0
  O  O16  1  0.17008411  0.34016922  0.58214922  1.0
  O  O17  1  0.17005271  0.82994729  0.91776522  1.0
  O  O18  1  0.17005271  0.34010642  0.91776522  1.0
  O  O19  1  0.82991335  0.17008665  0.08214889  1.0
  O  O20  1  0.34017430  0.17008665  0.08214889  1.0
  O  O21  1  0.65983078  0.82991589  0.58214922  1.0
  O  O22  1  0.17008411  0.82991589  0.58214922  1.0
  O  O23  1  0.82991335  0.65982570  0.08214889  1.0
  O  O24  1  0.51600277  0.03200454  0.24996793  1.0
  O  O25  1  0.48399851  0.51600149  0.74996495  1.0
  O  O26  1  0.03200198  0.51600149  0.74996495  1.0
  O  O27  1  0.96799546  0.48399723  0.24996793  1.0
  O  O28  1  0.51600277  0.48399723  0.24996793  1.0
  O  O29  1  0.48399851  0.96799802  0.74996495  1.0