# generated using pymatgen
data_LiRuN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.32466900
_cell_length_b   10.38918100
_cell_length_c   14.76693200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiRuN2
_chemical_formula_sum   'Li16 Ru16 N32'
_cell_volume   816.89117305
_cell_formula_units_Z   16
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  0.31687400  0.99000000  0.43628200  1
  Li  Li1  1  0.81687400  0.51000000  0.56371800  1
  Li  Li2  1  0.68312600  0.49000000  0.06371800  1
  Li  Li3  1  0.18312600  0.01000000  0.93628200  1
  Li  Li4  1  0.68312600  0.01000000  0.56371800  1
  Li  Li5  1  0.18312600  0.49000000  0.43628200  1
  Li  Li6  1  0.31687400  0.51000000  0.93628200  1
  Li  Li7  1  0.81687400  0.99000000  0.06371800  1
  Li  Li8  1  0.15022900  0.27855100  0.29645300  1
  Li  Li9  1  0.65022900  0.22144900  0.70354700  1
  Li  Li10  1  0.84977100  0.77855100  0.20354700  1
  Li  Li11  1  0.34977100  0.72144900  0.79645300  1
  Li  Li12  1  0.84977100  0.72144900  0.70354700  1
  Li  Li13  1  0.34977100  0.77855100  0.29645300  1
  Li  Li14  1  0.15022900  0.22144900  0.79645300  1
  Li  Li15  1  0.65022900  0.27855100  0.20354700  1
  Ru  Ru16  1  0.79299400  0.02130600  0.31117800  1
  Ru  Ru17  1  0.29299400  0.47869400  0.68882200  1
  Ru  Ru18  1  0.20700600  0.52130600  0.18882200  1
  Ru  Ru19  1  0.70700600  0.97869400  0.81117800  1
  Ru  Ru20  1  0.20700600  0.97869400  0.68882200  1
  Ru  Ru21  1  0.70700600  0.52130600  0.31117800  1
  Ru  Ru22  1  0.79299400  0.47869400  0.81117800  1
  Ru  Ru23  1  0.29299400  0.02130600  0.18882200  1
  Ru  Ru24  1  0.70335800  0.27855500  0.43429400  1
  Ru  Ru25  1  0.20335800  0.22144500  0.56570600  1
  Ru  Ru26  1  0.29664200  0.77855500  0.06570600  1
  Ru  Ru27  1  0.79664200  0.72144500  0.93429400  1
  Ru  Ru28  1  0.29664200  0.72144500  0.56570600  1
  Ru  Ru29  1  0.79664200  0.77855500  0.43429400  1
  Ru  Ru30  1  0.70335800  0.22144500  0.93429400  1
  Ru  Ru31  1  0.20335800  0.27855500  0.06570600  1
  N  N32  1  0.97398000  0.33452200  0.50874100  1
  N  N33  1  0.47398000  0.16547800  0.49125900  1
  N  N34  1  0.02602000  0.83452200  0.99125900  1
  N  N35  1  0.52602000  0.66547800  0.00874100  1
  N  N36  1  0.02602000  0.66547800  0.49125900  1
  N  N37  1  0.52602000  0.83452200  0.50874100  1
  N  N38  1  0.97398000  0.16547800  0.00874100  1
  N  N39  1  0.47398000  0.33452200  0.99125900  1
  N  N40  1  0.53611900  0.43026900  0.40216600  1
  N  N41  1  0.03611900  0.06973100  0.59783400  1
  N  N42  1  0.46388100  0.93026900  0.09783400  1
  N  N43  1  0.96388100  0.56973100  0.90216600  1
  N  N44  1  0.46388100  0.56973100  0.59783400  1
  N  N45  1  0.96388100  0.93026900  0.40216600  1
  N  N46  1  0.53611900  0.06973100  0.90216600  1
  N  N47  1  0.03611900  0.43026900  0.09783400  1
  N  N48  1  0.80042100  0.20143100  0.32181700  1
  N  N49  1  0.30042100  0.29856900  0.67818300  1
  N  N50  1  0.19957900  0.70143100  0.17818300  1
  N  N51  1  0.69957900  0.79856900  0.82181700  1
  N  N52  1  0.19957900  0.79856900  0.67818300  1
  N  N53  1  0.69957900  0.70143100  0.32181700  1
  N  N54  1  0.80042100  0.29856900  0.82181700  1
  N  N55  1  0.30042100  0.20143100  0.17818300  1
  N  N56  1  0.54754200  0.47318700  0.20200300  1
  N  N57  1  0.04754200  0.02681300  0.79799700  1
  N  N58  1  0.45245800  0.97318700  0.29799700  1
  N  N59  1  0.95245800  0.52681300  0.70200300  1
  N  N60  1  0.45245800  0.52681300  0.79799700  1
  N  N61  1  0.95245800  0.97318700  0.20200300  1
  N  N62  1  0.54754200  0.02681300  0.70200300  1
  N  N63  1  0.04754200  0.47318700  0.29799700  1
