# generated using pymatgen
data_NdNbO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.20644903
_cell_length_b   5.48057156
_cell_length_c   6.75161657
_cell_angle_alpha   112.28589230
_cell_angle_beta   110.94826842
_cell_angle_gamma   93.96227435
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdNbO4
_chemical_formula_sum   'Nd2 Nb2 O8'
_cell_volume   161.74223753
_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
  Nd  Nd0  1  0.12110486  0.37110486  0.74220971  1.0
  Nd  Nd1  1  0.87889514  0.62889514  0.25779029  1.0
  Nb  Nb2  1  0.64364245  0.89364245  0.78728391  1.0
  Nb  Nb3  1  0.35635755  0.10635755  0.21271609  1.0
  O  O4  1  0.78573659  0.94541502  0.58365349  1.0
  O  O5  1  0.29791689  0.63823847  0.58365349  1.0
  O  O6  1  0.21426341  0.05458498  0.41634651  1.0
  O  O7  1  0.70208311  0.36176153  0.41634651  1.0
  O  O8  1  0.08280178  0.27481955  0.06452253  1.0
  O  O9  1  0.48172175  0.78970398  0.06452253  1.0
  O  O10  1  0.91719822  0.72518045  0.93547747  1.0
  O  O11  1  0.51827825  0.21029602  0.93547747  1.0