# generated using pymatgen
data_Li2IrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.26683500
_cell_length_b   3.26683330
_cell_length_c   5.01974500
_cell_angle_alpha   89.99999959
_cell_angle_beta   90.00000974
_cell_angle_gamma   119.99996932
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2IrN2
_chemical_formula_sum   'Li2 Ir1 N2'
_cell_volume   46.39451031
_cell_formula_units_Z   1
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  0.66666700  0.33333300  0.35628900  1
  Li  Li1  1  0.33333300  0.66666700  0.64371100  1
  Ir  Ir2  1  0.00000000  0.00000000  0.00000000  1
  N  N3  1  0.66666700  0.33333300  0.79625500  1
  N  N4  1  0.33333300  0.66666700  0.20374500  1
