# generated using pymatgen
data_BaYCu4O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.31076268
_cell_length_b   6.31076268
_cell_length_c   10.45635600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000718
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaYCu4O7
_chemical_formula_sum   'Ba2 Y2 Cu8 O14'
_cell_volume   360.64063498
_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  0.48314200  1.0
  Ba  Ba1  1  0.33333300  0.66666700  0.98314200  1.0
  Y  Y2  1  0.66666700  0.33333300  0.87826200  1.0
  Y  Y3  1  0.33333300  0.66666700  0.37826200  1.0
  Cu  Cu4  1  0.83210000  0.16790000  0.18864500  1.0
  Cu  Cu5  1  0.66420000  0.83210000  0.68864500  1.0
  Cu  Cu6  1  0.16790000  0.33580000  0.68864500  1.0
  Cu  Cu7  1  0.83210000  0.66420000  0.18864500  1.0
  Cu  Cu8  1  0.33580000  0.16790000  0.18864500  1.0
  Cu  Cu9  1  0.16790000  0.83210000  0.68864500  1.0
  Cu  Cu10  1  0.00000000  0.00000000  0.43938600  1.0
  Cu  Cu11  1  0.00000000  0.00000000  0.93938600  1.0
  O  O12  1  0.83619500  0.16380500  0.00619100  1.0
  O  O13  1  0.67239100  0.83619500  0.50619100  1.0
  O  O14  1  0.16380500  0.32760900  0.50619100  1.0
  O  O15  1  0.83619500  0.67239100  0.00619100  1.0
  O  O16  1  0.32760900  0.16380500  0.00619100  1.0
  O  O17  1  0.16380500  0.83619500  0.50619100  1.0
  O  O18  1  0.00000000  0.00000000  0.75455500  1.0
  O  O19  1  0.00000000  0.00000000  0.25455500  1.0
  O  O20  1  0.50862800  0.49137200  0.26471500  1.0
  O  O21  1  0.01725600  0.50862800  0.76471500  1.0
  O  O22  1  0.49137200  0.98274400  0.76471500  1.0
  O  O23  1  0.50862800  0.01725600  0.26471500  1.0
  O  O24  1  0.49137200  0.50862800  0.76471500  1.0
  O  O25  1  0.98274400  0.49137200  0.26471500  1.0