# generated using pymatgen
data_Ba3FeRu2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81253528
_cell_length_b   5.81253528
_cell_length_c   14.13902300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999176
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3FeRu2O9
_chemical_formula_sum   'Ba6 Fe2 Ru4 O18'
_cell_volume   413.69595252
_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  0.08901100  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.91098900  1.0
  Ba  Ba2  1  0.66666700  0.33333300  0.58901100  1.0
  Ba  Ba3  1  0.33333300  0.66666700  0.41098900  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.25000000  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.75000000  1.0
  Fe  Fe6  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe7  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru8  1  0.33333300  0.66666700  0.66029500  1.0
  Ru  Ru9  1  0.66666700  0.33333300  0.33970500  1.0
  Ru  Ru10  1  0.66666700  0.33333300  0.16029500  1.0
  Ru  Ru11  1  0.33333300  0.66666700  0.83970500  1.0
  O  O12  1  0.16856800  0.33713600  0.58224200  1.0
  O  O13  1  0.83143200  0.66286400  0.41775800  1.0
  O  O14  1  0.66286400  0.83143200  0.58224200  1.0
  O  O15  1  0.83143200  0.66286400  0.08224200  1.0
  O  O16  1  0.33713600  0.16856800  0.41775800  1.0
  O  O17  1  0.16856800  0.33713600  0.91775800  1.0
  O  O18  1  0.16856800  0.83143200  0.58224200  1.0
  O  O19  1  0.33713600  0.16856800  0.08224200  1.0
  O  O20  1  0.83143200  0.16856800  0.41775800  1.0
  O  O21  1  0.66286400  0.83143200  0.91775800  1.0
  O  O22  1  0.83143200  0.16856800  0.08224200  1.0
  O  O23  1  0.16856800  0.83143200  0.91775800  1.0
  O  O24  1  0.50895100  0.01790100  0.25000000  1.0
  O  O25  1  0.49104900  0.98209900  0.75000000  1.0
  O  O26  1  0.98209900  0.49104900  0.25000000  1.0
  O  O27  1  0.01790100  0.50895100  0.75000000  1.0
  O  O28  1  0.50895100  0.49104900  0.25000000  1.0
  O  O29  1  0.49104900  0.50895100  0.75000000  1.0