# generated using pymatgen
data_IrC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.16004562
_cell_length_b   4.16004562
_cell_length_c   4.16004562
_cell_angle_alpha   113.48362396
_cell_angle_beta   113.48362396
_cell_angle_gamma   101.71397407
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrC2
_chemical_formula_sum   'Ir2 C4'
_cell_volume   54.67343777
_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  0.75000000  0.75000000  0.00000000  1.0
  Ir  Ir1  1  0.25000000  0.25000000  0.00000000  1.0
  C  C2  1  0.11280300  0.61280300  0.72560700  1.0
  C  C3  1  0.88719700  0.38719700  0.27439300  1.0
  C  C4  1  0.61280300  0.88719700  0.50000000  1.0
  C  C5  1  0.38719700  0.11280300  0.50000000  1.0