# generated using pymatgen
data_LiRuN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.62574700
_cell_length_b   6.61799500
_cell_length_c   5.33273300
_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   'Li4 Ru4 N8'
_cell_volume   198.54386498
_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  0.58123200  0.37726100  0.00088900  1
  Li  Li1  1  0.41876800  0.62273900  0.50088900  1
  Li  Li2  1  0.91876800  0.87726100  0.50088900  1
  Li  Li3  1  0.08123200  0.12273900  0.00088900  1
  Ru  Ru4  1  0.57404500  0.87325700  0.00589300  1
  Ru  Ru5  1  0.42595500  0.12674300  0.50589300  1
  Ru  Ru6  1  0.92595500  0.37325700  0.50589300  1
  Ru  Ru7  1  0.07404500  0.62674300  0.00589300  1
  N  N8  1  0.60466900  0.35580200  0.40508200  1
  N  N9  1  0.39533100  0.64419800  0.90508200  1
  N  N10  1  0.89533100  0.85580200  0.90508200  1
  N  N11  1  0.10466900  0.14419800  0.40508200  1
  N  N12  1  0.56123300  0.89619400  0.35813600  1
  N  N13  1  0.43876700  0.10380600  0.85813600  1
  N  N14  1  0.93876700  0.39619400  0.85813600  1
  N  N15  1  0.06123300  0.60380600  0.35813600  1
