# generated using pymatgen
data_Li3NbN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.62965218
_cell_length_b   9.96466379
_cell_length_c   9.96466370
_cell_angle_alpha   90.00000364
_cell_angle_beta   125.26439096
_cell_angle_gamma   54.73560940
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3NbN2
_chemical_formula_sum   'Li24 Nb8 N16'
_cell_volume   494.71828748
_cell_formula_units_Z   8
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  0.21358583  0.05524698  0.99695023  1
  Li  Li1  1  0.78641417  0.76883280  0.50304977  1
  Li  Li2  1  0.78641417  0.44475302  0.78336440  1
  Li  Li3  1  0.21358583  0.73116720  0.71663560  1
  Li  Li4  1  0.21968537  0.78336440  0.27188257  1
  Li  Li5  1  0.78031463  0.71663560  0.05219721  1
  Li  Li6  1  0.21968537  0.99695023  0.44780279  1
  Li  Li7  1  0.78031463  0.50304977  0.22811743  1
  Li  Li8  1  0.67592022  0.05219721  0.73116720  1
  Li  Li9  1  0.67592022  0.27188257  0.44475302  1
  Li  Li10  1  0.32407978  0.22811743  0.76883280  1
  Li  Li11  1  0.32407978  0.44780279  0.05524698  1
  Li  Li12  1  0.78641417  0.94475302  0.00304977  1
  Li  Li13  1  0.21358583  0.23116720  0.49695023  1
  Li  Li14  1  0.21358583  0.55524698  0.21663560  1
  Li  Li15  1  0.78641417  0.26883280  0.28336440  1
  Li  Li16  1  0.78031463  0.21663560  0.72811743  1
  Li  Li17  1  0.21968537  0.28336440  0.94780279  1
  Li  Li18  1  0.78031463  0.00304977  0.55219721  1
  Li  Li19  1  0.21968537  0.49695023  0.77188257  1
  Li  Li20  1  0.32407978  0.94780279  0.26883280  1
  Li  Li21  1  0.32407978  0.72811743  0.55524698  1
  Li  Li22  1  0.67592022  0.77188257  0.23116720  1
  Li  Li23  1  0.67592022  0.55219721  0.94475302  1
  Nb  Nb24  1  0.23731659  1.00000000  0.73731659  1
  Nb  Nb25  1  0.76268341  0.73731659  0.76268341  1
  Nb  Nb26  1  0.76268341  0.50000000  0.50000000  1
  Nb  Nb27  1  0.23731659  0.76268341  0.00000000  1
  Nb  Nb28  1  0.76268341  0.00000000  0.26268341  1
  Nb  Nb29  1  0.23731659  0.26268341  0.23731659  1
  Nb  Nb30  1  0.23731659  0.50000000  0.50000000  1
  Nb  Nb31  1  0.76268341  0.23731659  1.00000000  1
  N  N32  1  -0.00000000  0.00000000  0.50000000  1
  N  N33  1  -0.00000000  0.50000000  -0.00000000  1
  N  N34  1  -0.00000000  0.50000000  0.50000000  1
  N  N35  1  -0.00000000  0.00000000  -0.00000000  1
  N  N36  1  0.50000000  0.98463728  0.75000000  1
  N  N37  1  0.50000000  0.51536272  0.25000000  1
  N  N38  1  0.00000000  0.25000000  0.73463728  1
  N  N39  1  -0.00000000  0.75000000  0.76536272  1
  N  N40  1  0.53072443  0.73463728  0.51536272  1
  N  N41  1  0.46927557  0.76536272  0.98463728  1
  N  N42  1  0.50000000  0.01536272  0.25000000  1
  N  N43  1  0.50000000  0.48463728  0.75000000  1
  N  N44  1  -0.00000000  0.75000000  0.26536272  1
  N  N45  1  0.00000000  0.25000000  0.23463728  1
  N  N46  1  0.46927557  0.26536272  0.48463728  1
  N  N47  1  0.53072443  0.23463728  0.01536272  1
