# generated using pymatgen
data_Ba3FeRu2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80262864
_cell_length_b   5.80262864
_cell_length_c   14.20295400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000734
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3FeRu2O9
_chemical_formula_sum   'Ba6 Fe2 Ru4 O18'
_cell_volume   414.15111512
_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  0.59276600  1.0
  Ba  Ba1  1  0.33333300  0.66666700  0.40589700  1.0
  Ba  Ba2  1  0.33333300  0.66666700  0.09276600  1.0
  Ba  Ba3  1  0.66666700  0.33333300  0.90589700  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.75256600  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.25256600  1.0
  Fe  Fe6  1  0.66666700  0.33333300  0.34891700  1.0
  Fe  Fe7  1  0.33333300  0.66666700  0.84891700  1.0
  Ru  Ru8  1  0.00000000  0.00000000  0.50257300  1.0
  Ru  Ru9  1  0.00000000  0.00000000  0.00257300  1.0
  Ru  Ru10  1  0.33333300  0.66666700  0.65688700  1.0
  Ru  Ru11  1  0.66666700  0.33333300  0.15688700  1.0
  O  O12  1  0.48533800  0.97067600  0.74650500  1.0
  O  O13  1  0.48533800  0.51466200  0.74650500  1.0
  O  O14  1  0.02932400  0.51466200  0.74650500  1.0
  O  O15  1  0.51466200  0.02932400  0.24650500  1.0
  O  O16  1  0.51466200  0.48533800  0.24650500  1.0
  O  O17  1  0.97067600  0.48533800  0.24650500  1.0
  O  O18  1  0.16558000  0.33116100  0.58002200  1.0
  O  O19  1  0.16558000  0.83442000  0.58002200  1.0
  O  O20  1  0.66883900  0.83442000  0.58002200  1.0
  O  O21  1  0.83742800  0.67485700  0.42027800  1.0
  O  O22  1  0.83742800  0.16257200  0.42027800  1.0
  O  O23  1  0.32514300  0.16257200  0.42027800  1.0
  O  O24  1  0.83442000  0.66883900  0.08002200  1.0
  O  O25  1  0.83442000  0.16558000  0.08002200  1.0
  O  O26  1  0.33116100  0.16558000  0.08002200  1.0
  O  O27  1  0.16257200  0.32514300  0.92027800  1.0
  O  O28  1  0.16257200  0.83742800  0.92027800  1.0
  O  O29  1  0.67485700  0.83742800  0.92027800  1.0