# generated using pymatgen data_LaCd2(H6Ir)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.72979205 _cell_length_b 4.72979192 _cell_length_c 8.36897597 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000090 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaCd2(H6Ir)2 _chemical_formula_sum 'La1 Cd2 H12 Ir2' _cell_volume 162.13882839 _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 La La0 1 0.00000000 0.00000000 0.00000000 1.0 Cd Cd1 1 0.66666700 0.33333300 0.37050602 1.0 Cd Cd2 1 0.33333300 0.66666700 0.62949398 1.0 H H3 1 0.16282698 0.83717302 0.36386959 1.0 H H4 1 0.67434504 0.83717302 0.36386959 1.0 H H5 1 0.16282698 0.32565496 0.36386959 1.0 H H6 1 0.83717302 0.16282698 0.63613041 1.0 H H7 1 0.32565496 0.16282698 0.63613041 1.0 H H8 1 0.83717302 0.67434504 0.63613041 1.0 H H9 1 0.50488173 0.00976446 0.86772640 1.0 H H10 1 0.50488173 0.49511827 0.86772640 1.0 H H11 1 0.99023554 0.49511827 0.86772640 1.0 H H12 1 0.49511827 0.99023554 0.13227360 1.0 H H13 1 0.49511827 0.50488173 0.13227360 1.0 H H14 1 0.00976446 0.50488173 0.13227360 1.0 Ir Ir15 1 0.66666700 0.33333300 0.74092944 1.0 Ir Ir16 1 0.33333300 0.66666700 0.25907056 1.0