# generated using pymatgen
data_Ir(N3O4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.69269780
_cell_length_b   6.69269780
_cell_length_c   6.69269780
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ir(N3O4)3
_chemical_formula_sum   'Ir1 N9 O12'
_cell_volume   211.97695476
_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
  Ir  Ir0  1  0.00000000  0.00000000  0.00000000  1.0
  N  N1  1  0.71229000  0.71229000  0.28771000  1.0
  N  N2  1  0.28771000  0.71229000  0.28771000  1.0
  N  N3  1  0.71229000  0.28771000  0.28771000  1.0
  N  N4  1  0.28771000  0.28771000  0.71229000  1.0
  N  N5  1  0.71229000  0.28771000  0.71229000  1.0
  N  N6  1  0.28771000  0.71229000  0.71229000  1.0
  N  N7  1  0.50000000  0.50000000  0.50000000  1.0
  N  N8  1  0.75000000  0.75000000  0.75000000  1.0
  N  N9  1  0.25000000  0.25000000  0.25000000  1.0
  O  O10  1  0.00000000  0.66296600  0.33703400  1.0
  O  O11  1  0.00000000  0.00000000  0.33703400  1.0
  O  O12  1  0.66296600  0.00000000  0.33703400  1.0
  O  O13  1  0.00000000  0.33703400  0.66296600  1.0
  O  O14  1  0.66296600  0.33703400  0.00000000  1.0
  O  O15  1  0.00000000  0.33703400  0.00000000  1.0
  O  O16  1  0.33703400  0.00000000  0.00000000  1.0
  O  O17  1  0.33703400  0.66296600  0.00000000  1.0
  O  O18  1  0.33703400  0.00000000  0.66296600  1.0
  O  O19  1  0.66296600  0.00000000  0.00000000  1.0
  O  O20  1  0.00000000  0.00000000  0.66296600  1.0
  O  O21  1  0.00000000  0.66296600  0.00000000  1.0