# generated using pymatgen
data_BaCuRu5O11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.93724972
_cell_length_b   5.93724972
_cell_length_c   14.05172000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999683
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaCuRu5O11
_chemical_formula_sum   'Ba2 Cu2 Ru10 O22'
_cell_volume   428.97379558
_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  0.75000000  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.25000000  1.0
  Cu  Cu2  1  0.33333300  0.66666700  0.25000000  1.0
  Cu  Cu3  1  0.66666700  0.33333300  0.75000000  1.0
  Ru  Ru4  1  0.00000000  0.00000000  0.15301400  1.0
  Ru  Ru5  1  0.00000000  0.00000000  0.84698600  1.0
  Ru  Ru6  1  0.00000000  0.00000000  0.65301400  1.0
  Ru  Ru7  1  0.00000000  0.00000000  0.34698600  1.0
  Ru  Ru8  1  0.50000000  0.00000000  0.00000000  1.0
  Ru  Ru9  1  0.00000000  0.50000000  0.00000000  1.0
  Ru  Ru10  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru11  1  0.50000000  0.50000000  0.00000000  1.0
  Ru  Ru12  1  0.00000000  0.50000000  0.50000000  1.0
  Ru  Ru13  1  0.50000000  0.50000000  0.50000000  1.0
  O  O14  1  0.14720100  0.29440300  0.25000000  1.0
  O  O15  1  0.85279900  0.70559700  0.75000000  1.0
  O  O16  1  0.70559700  0.85279900  0.25000000  1.0
  O  O17  1  0.29440300  0.14720100  0.75000000  1.0
  O  O18  1  0.14720100  0.85279900  0.25000000  1.0
  O  O19  1  0.85279900  0.14720100  0.75000000  1.0
  O  O20  1  0.33333300  0.66666700  0.08244800  1.0
  O  O21  1  0.66666700  0.33333300  0.91755200  1.0
  O  O22  1  0.66666700  0.33333300  0.58244800  1.0
  O  O23  1  0.33333300  0.66666700  0.41755200  1.0
  O  O24  1  0.16937800  0.33875700  0.58028700  1.0
  O  O25  1  0.83062200  0.66124300  0.41971300  1.0
  O  O26  1  0.66124300  0.83062200  0.58028700  1.0
  O  O27  1  0.83062200  0.66124300  0.08028700  1.0
  O  O28  1  0.33875700  0.16937800  0.41971300  1.0
  O  O29  1  0.16937800  0.33875700  0.91971300  1.0
  O  O30  1  0.16937800  0.83062200  0.58028700  1.0
  O  O31  1  0.33875700  0.16937800  0.08028700  1.0
  O  O32  1  0.83062200  0.16937800  0.41971300  1.0
  O  O33  1  0.66124300  0.83062200  0.91971300  1.0
  O  O34  1  0.83062200  0.16937800  0.08028700  1.0
  O  O35  1  0.16937800  0.83062200  0.91971300  1.0