# generated using pymatgen
data_Ba2NdNbO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.11789269
_cell_length_b   6.11789269
_cell_length_c   6.17854721
_cell_angle_alpha   60.04388255
_cell_angle_beta   60.04388255
_cell_angle_gamma   60.11223137
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2NdNbO6
_chemical_formula_sum   'Ba2 Nd1 Nb1 O6'
_cell_volume   163.76848159
_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  0.24842400  0.24842400  0.25737300  1.0
  Ba  Ba1  1  0.75157600  0.75157600  0.74262700  1.0
  Nd  Nd2  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb3  1  0.50000000  0.50000000  0.50000000  1.0
  O  O4  1  0.30135600  0.76854300  0.69454100  1.0
  O  O5  1  0.23145700  0.69864400  0.30545900  1.0
  O  O6  1  0.69864400  0.23145700  0.30545900  1.0
  O  O7  1  0.76854300  0.30135600  0.69454100  1.0
  O  O8  1  0.73037700  0.73037700  0.20518600  1.0
  O  O9  1  0.26962300  0.26962300  0.79481400  1.0