# generated using pymatgen
data_Li2IrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.00782177
_cell_length_b   11.01814438
_cell_length_c   5.66793726
_cell_angle_alpha   90.00000140
_cell_angle_beta   87.12527097
_cell_angle_gamma   23.51101984
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2IrN2
_chemical_formula_sum   'Li6 Ir3 N6'
_cell_volume   148.48507183
_cell_formula_units_Z   3
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  0.72233500  0.95945000  0.83665600  1
  Li  Li1  1  0.72233500  0.31821500  0.83665600  1
  Li  Li2  1  0.27766500  0.04055000  0.16334400  1
  Li  Li3  1  0.27766500  0.68178500  0.16334400  1
  Li  Li4  1  0.21418000  0.89291000  0.68296400  1
  Li  Li5  1  0.78582000  0.10709000  0.31703600  1
  Ir  Ir6  1  0.00000000  0.50000000  0.00000000  1
  Ir  Ir7  1  0.00000000  0.35016800  0.50000000  1
  Ir  Ir8  1  0.00000000  0.64983200  0.50000000  1
  N  N9  1  0.59686000  0.83857900  0.82723700  1
  N  N10  1  0.59686000  0.56456100  0.82723700  1
  N  N11  1  0.40314000  0.16142100  0.17276300  1
  N  N12  1  0.40314000  0.43543900  0.17276300  1
  N  N13  1  0.59497900  0.70251000  0.34760600  1
  N  N14  1  0.40502100  0.29749000  0.65239400  1
