# generated using pymatgen
data_IrN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.86690700
_cell_length_b   2.86690700
_cell_length_c   6.56225100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99997685
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrN
_chemical_formula_sum   'Ir2 N2'
_cell_volume   46.71009815
_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  0.52774800  1.0
  Ir  Ir1  1  0.33333300  0.66666700  0.02774800  1.0
  N  N2  1  0.66666700  0.33333300  0.84725300  1.0
  N  N3  1  0.33333300  0.66666700  0.34725300  1.0