# generated using pymatgen
data_Li3NbO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.28900888
_cell_length_b   7.28900552
_cell_length_c   7.28900480
_cell_angle_alpha   109.47140037
_cell_angle_beta   109.47145239
_cell_angle_gamma   109.47141122
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3NbO4
_chemical_formula_sum   'Li12 Nb4 O16'
_cell_volume   298.11228728
_cell_formula_units_Z   4
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
  Li  Li0  1  0.72788959  0.24044968  0.72788931  1
  Li  Li1  1  0.27208605  0.00005510  0.51257822  1
  Li  Li2  1  0.51257856  0.00005663  0.27208701  1
  Li  Li3  1  0.75950714  0.48743847  0.48743937  1
  Li  Li4  1  0.48744114  0.75950623  0.48743997  1
  Li  Li5  1  0.24044874  0.72788828  0.72789100  1
  Li  Li6  1  0.27208541  0.51257744  0.00005490  1
  Li  Li7  1  0.00005608  0.51257916  0.27208755  1
  Li  Li8  1  0.72788691  0.72788936  0.24044888  1
  Li  Li9  1  0.00005410  0.27208594  0.51257694  1
  Li  Li10  1  0.51257806  0.27208661  0.00005529  1
  Li  Li11  1  0.48743953  0.48743992  0.75950575  1
  Nb  Nb12  1  -0.00000604  -0.00000614  0.71715622  1
  Nb  Nb13  1  -0.00000583  0.71715684  -0.00000506  1
  Nb  Nb14  1  0.71715596  0.99999333  0.99999250  1
  Nb  Nb15  1  0.28282155  0.28282114  0.28282185  1
  O  O16  1  0.48880100  0.24692808  0.48880089  1
  O  O17  1  0.24187613  0.24187571  0.75307294  1
  O  O18  1  0.75812188  0.51119057  -0.00000388  1
  O  O19  1  0.51119042  0.75812215  -0.00000438  1
  O  O20  1  0.77095417  0.77095427  0.77095418  1
  O  O21  1  0.22904491  0.00000247  0.00000236  1
  O  O22  1  0.00000329  0.22904477  0.00000261  1
  O  O23  1  0.00000246  0.00000269  0.22904463  1
  O  O24  1  0.48880262  0.48880233  0.24693089  1
  O  O25  1  0.51119253  -0.00000360  0.75811931  1
  O  O26  1  -0.00000382  0.51119087  0.75812239  1
  O  O27  1  0.24187589  0.75307304  0.24187599  1
  O  O28  1  -0.00000385  0.75812188  0.51119092  1
  O  O29  1  0.75812228  -0.00000364  0.51119065  1
  O  O30  1  0.75307344  0.24187594  0.24187555  1
  O  O31  1  0.24693070  0.48880249  0.48880322  1
