# generated using pymatgen
data_Ba(CuO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.63883200
_cell_length_b   6.63883200
_cell_length_c   6.28643700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba(CuO)4
_chemical_formula_sum   'Ba2 Cu8 O8'
_cell_volume   277.06899216
_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  0.00000000  0.00000000  0.00000000  1.0
  Ba  Ba1  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu2  1  0.75000000  0.25000000  0.50000000  1.0
  Cu  Cu3  1  0.25000000  0.75000000  0.50000000  1.0
  Cu  Cu4  1  0.75000000  0.75000000  0.50000000  1.0
  Cu  Cu5  1  0.25000000  0.25000000  0.50000000  1.0
  Cu  Cu6  1  0.50000000  0.00000000  0.74215600  1.0
  Cu  Cu7  1  0.50000000  0.00000000  0.25784400  1.0
  Cu  Cu8  1  0.00000000  0.50000000  0.25784400  1.0
  Cu  Cu9  1  0.00000000  0.50000000  0.74215600  1.0
  O  O10  1  0.80917900  0.30917900  0.77158000  1.0
  O  O11  1  0.69082100  0.19082100  0.22842000  1.0
  O  O12  1  0.19082100  0.69082100  0.77158000  1.0
  O  O13  1  0.30917900  0.80917900  0.22842000  1.0
  O  O14  1  0.30917900  0.19082100  0.77158000  1.0
  O  O15  1  0.80917900  0.69082100  0.22842000  1.0
  O  O16  1  0.19082100  0.30917900  0.22842000  1.0
  O  O17  1  0.69082100  0.80917900  0.77158000  1.0