# generated using pymatgen
data_Ba2Nd(CuO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.92522700
_cell_length_b   3.92522700
_cell_length_c   12.14195000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Nd(CuO2)3
_chemical_formula_sum   'Ba2 Nd1 Cu3 O6'
_cell_volume   187.07596544
_cell_formula_units_Z   1
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  0.50000000  0.50000000  0.80590900  1.0
  Ba  Ba1  1  0.50000000  0.50000000  0.19409100  1.0
  Nd  Nd2  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu3  1  0.00000000  0.00000000  0.35887200  1.0
  Cu  Cu4  1  0.00000000  0.00000000  0.64112800  1.0
  Cu  Cu5  1  0.00000000  0.00000000  0.00000000  1.0
  O  O6  1  0.00000000  0.00000000  0.85203300  1.0
  O  O7  1  0.00000000  0.00000000  0.14796700  1.0
  O  O8  1  0.50000000  0.00000000  0.62766800  1.0
  O  O9  1  0.00000000  0.50000000  0.62766800  1.0
  O  O10  1  0.50000000  0.00000000  0.37233200  1.0
  O  O11  1  0.00000000  0.50000000  0.37233200  1.0