# generated using pymatgen
data_Ba2PrNb(CuO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.89135970
_cell_length_b   12.89135970
_cell_length_c   12.89135970
_cell_angle_alpha   154.67247582
_cell_angle_beta   154.67247582
_cell_angle_gamma   36.12290323
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2PrNb(CuO4)2
_chemical_formula_sum   'Ba4 Pr2 Nb2 Cu4 O16'
_cell_volume   391.56830070
_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  0.90150400  0.40150400  0.50000000  1.0
  Ba  Ba1  1  0.40150400  0.90150400  0.50000000  1.0
  Ba  Ba2  1  0.09849600  0.59849600  0.50000000  1.0
  Ba  Ba3  1  0.59849600  0.09849600  0.50000000  1.0
  Pr  Pr4  1  0.75000000  0.25000000  0.50000000  1.0
  Pr  Pr5  1  0.25000000  0.75000000  0.50000000  1.0
  Nb  Nb6  1  0.50000000  0.50000000  0.00000000  1.0
  Nb  Nb7  1  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu8  1  0.32059900  0.32059900  0.00000000  1.0
  Cu  Cu9  1  0.82059900  0.82059900  0.00000000  1.0
  Cu  Cu10  1  0.67940100  0.67940100  0.00000000  1.0
  Cu  Cu11  1  0.17940100  0.17940100  0.00000000  1.0
  O  O12  1  0.29060900  0.79060900  0.08121700  1.0
  O  O13  1  0.70939100  0.20939100  0.91878300  1.0
  O  O14  1  0.79060900  0.70939100  0.50000000  1.0
  O  O15  1  0.20939100  0.29060900  0.50000000  1.0
  O  O16  1  0.41840400  0.41840400  0.00000000  1.0
  O  O17  1  0.91840400  0.91840400  0.00000000  1.0
  O  O18  1  0.58159600  0.58159600  0.00000000  1.0
  O  O19  1  0.08159600  0.08159600  0.00000000  1.0
  O  O20  1  0.06167100  0.56167100  0.99681400  1.0
  O  O21  1  0.56485600  0.06485600  0.00318600  1.0
  O  O22  1  0.56167100  0.56485600  0.50000000  1.0
  O  O23  1  0.06485600  0.06167100  0.50000000  1.0
  O  O24  1  0.93832900  0.43832900  0.00318600  1.0
  O  O25  1  0.43514400  0.93514400  0.99681400  1.0
  O  O26  1  0.43832900  0.43514400  0.50000000  1.0
  O  O27  1  0.93514400  0.93832900  0.50000000  1.0