# generated using pymatgen data_CeZr(ScRu2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.54573527 _cell_length_b 4.61883003 _cell_length_c 9.27423112 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CeZr(ScRu2)2 _chemical_formula_sum 'Ce2 Zr2 Sc4 Ru8' _cell_volume 280.39375211 _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 Ce Ce0 1 0.74995220 0.25000000 0.12235690 1.0 Ce Ce1 1 0.24995320 0.75000000 0.37764210 1.0 Zr Zr2 1 0.75005457 0.25000000 0.62657994 1.0 Zr Zr3 1 0.25005357 0.75000000 0.87341906 1.0 Sc Sc4 1 0.24993960 0.25000000 0.11752035 1.0 Sc Sc5 1 0.74994060 0.75000000 0.38247965 1.0 Sc Sc6 1 0.25005106 0.25000000 0.63219599 1.0 Sc Sc7 1 0.75005006 0.75000000 0.86780501 1.0 Ru Ru8 1 0.49890944 0.75000000 0.12166037 1.0 Ru Ru9 1 0.00100447 0.75000000 0.12166209 1.0 Ru Ru10 1 0.50100347 0.25000000 0.37833891 1.0 Ru Ru11 1 0.99890944 0.25000000 0.37833963 1.0 Ru Ru12 1 0.99873112 0.75000000 0.62812132 1.0 Ru Ru13 1 0.50135755 0.75000000 0.62813588 1.0 Ru Ru14 1 0.00135755 0.25000000 0.87186512 1.0 Ru Ru15 1 0.49873012 0.25000000 0.87187868 1.0