# generated using pymatgen data_IrC2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.16608365 _cell_length_b 5.16608365 _cell_length_c 9.40934600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 104.96959037 _symmetry_Int_Tables_number 1 _chemical_formula_structural IrC2 _chemical_formula_sum 'Ir8 C16' _cell_volume 242.59831632 _cell_formula_units_Z 8 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 0.74427800 0.25572200 0.50000000 1.0 Ir Ir1 1 0.24427800 0.75572200 0.00000000 1.0 Ir Ir2 1 0.25572200 0.74427800 0.50000000 1.0 Ir Ir3 1 0.75572200 0.24427800 0.00000000 1.0 Ir Ir4 1 0.30371000 0.30371000 0.70611200 1.0 Ir Ir5 1 0.69629000 0.69629000 0.29388800 1.0 Ir Ir6 1 0.19629000 0.19629000 0.20611200 1.0 Ir Ir7 1 0.80371000 0.80371000 0.79388800 1.0 C C8 1 0.67182200 0.83695100 0.51567800 1.0 C C9 1 0.16304900 0.32817800 0.48432200 1.0 C C10 1 0.66304900 0.82817800 0.01567800 1.0 C C11 1 0.17182200 0.33695100 0.98432200 1.0 C C12 1 0.32817800 0.16304900 0.48432200 1.0 C C13 1 0.83695100 0.67182200 0.51567800 1.0 C C14 1 0.33695100 0.17182200 0.98432200 1.0 C C15 1 0.82817800 0.66304900 0.01567800 1.0 C C16 1 0.62094800 0.27349100 0.21652100 1.0 C C17 1 0.72650900 0.37905200 0.78347900 1.0 C C18 1 0.22650900 0.87905200 0.71652100 1.0 C C19 1 0.12094800 0.77349100 0.28347900 1.0 C C20 1 0.37905200 0.72650900 0.78347900 1.0 C C21 1 0.27349100 0.62094800 0.21652100 1.0 C C22 1 0.77349100 0.12094800 0.28347900 1.0 C C23 1 0.87905200 0.22650900 0.71652100 1.0