# generated using pymatgen data_Ce8Si12Ni3Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.09262014 _cell_length_b 8.09262043 _cell_length_c 8.49178162 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999469 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce8Si12Ni3Ru _chemical_formula_sum 'Ce8 Si12 Ni3 Ru1' _cell_volume 481.62364278 _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 Ce Ce0 1 0.00000000 0.00000000 0.24882119 1.0 Ce Ce1 1 0.00000000 0.00000000 0.75088688 1.0 Ce Ce2 1 0.49777261 0.50222739 0.25365965 1.0 Ce Ce3 1 0.49777261 0.99554522 0.25365965 1.0 Ce Ce4 1 0.00445478 0.50222739 0.25365965 1.0 Ce Ce5 1 0.49794188 0.50205812 0.74645222 1.0 Ce Ce6 1 0.49794188 0.99588276 0.74645222 1.0 Ce Ce7 1 0.00411724 0.50205812 0.74645222 1.0 Si Si8 1 0.16549255 0.83450745 0.50147485 1.0 Si Si9 1 0.16549255 0.33098611 0.50147485 1.0 Si Si10 1 0.66901389 0.83450745 0.50147485 1.0 Si Si11 1 0.82986689 0.17013311 0.49945688 1.0 Si Si12 1 0.82986689 0.65973478 0.49945688 1.0 Si Si13 1 0.34026522 0.17013311 0.49945688 1.0 Si Si14 1 0.82924296 0.17075704 0.99955462 1.0 Si Si15 1 0.82924296 0.65848392 0.99955462 1.0 Si Si16 1 0.34151608 0.17075704 0.99955462 1.0 Si Si17 1 0.17007691 0.82992309 0.99964588 1.0 Si Si18 1 0.17007691 0.34015582 0.99964588 1.0 Si Si19 1 0.65984418 0.82992309 0.99964588 1.0 Ni Ni20 1 0.66666700 0.33333300 0.50188786 1.0 Ni Ni21 1 0.66666700 0.33333300 0.99970291 1.0 Ni Ni22 1 0.33333300 0.66666700 0.00090529 1.0 Ru Ru23 1 0.33333300 0.66666700 0.49706259 1.0