# generated using pymatgen
data_IrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.09489998
_cell_length_b   3.09489998
_cell_length_c   7.49554000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999959
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrN2
_chemical_formula_sum   'Ir2 N4'
_cell_volume   62.17657514
_cell_formula_units_Z   2
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
  Ir  Ir0  1  0.66666700  0.33333300  0.25000000  1.0
  Ir  Ir1  1  0.33333300  0.66666700  0.75000000  1.0
  N  N2  1  0.00000000  0.00000000  0.41639100  1.0
  N  N3  1  0.00000000  0.00000000  0.58360900  1.0
  N  N4  1  0.00000000  0.00000000  0.91639100  1.0
  N  N5  1  0.00000000  0.00000000  0.08360900  1.0