# generated using pymatgen
data_IrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.93321300
_cell_length_b   4.87907500
_cell_length_c   4.91748228
_cell_angle_alpha   72.06176629
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrN2
_chemical_formula_sum   'Ir4 N8'
_cell_volume   112.60776339
_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
  Ir  Ir0  1  0.49972400  0.23315600  0.27923500  1.0
  Ir  Ir1  1  0.99972400  0.76684400  0.22076500  1.0
  Ir  Ir2  1  0.50027600  0.76684400  0.72076500  1.0
  Ir  Ir3  1  0.00027600  0.23315600  0.77923500  1.0
  N  N4  1  0.91361500  0.32460700  0.34080800  1.0
  N  N5  1  0.41361500  0.67539300  0.15919200  1.0
  N  N6  1  0.08638500  0.67539300  0.65919200  1.0
  N  N7  1  0.58638500  0.32460700  0.84080800  1.0
  N  N8  1  0.40265600  0.18569300  0.70056800  1.0
  N  N9  1  0.90265600  0.81430700  0.79943200  1.0
  N  N10  1  0.59734400  0.81430700  0.29943200  1.0
  N  N11  1  0.09734400  0.18569300  0.20056800  1.0