# generated using pymatgen data_Zr4Sc4Os5Ru3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.48894172 _cell_length_b 4.56871227 _cell_length_c 9.13493511 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00255046 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4Sc4Os5Ru3 _chemical_formula_sum 'Zr4 Sc4 Os5 Ru3' _cell_volume 270.81526957 _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 Zr Zr0 1 0.75002637 0.25000000 0.12510391 1.0 Zr Zr1 1 0.24971263 0.75000000 0.37492717 1.0 Zr Zr2 1 0.75039980 0.25000000 0.62483290 1.0 Zr Zr3 1 0.24986026 0.75000000 0.87513244 1.0 Sc Sc4 1 0.24977396 0.25000000 0.12481022 1.0 Sc Sc5 1 0.74984984 0.75000000 0.37508701 1.0 Sc Sc6 1 0.25016851 0.25000000 0.62513891 1.0 Sc Sc7 1 0.75017511 0.75000000 0.87497087 1.0 Os Os8 1 0.49992345 0.75000000 0.12447612 1.0 Os Os9 1 0.00002584 0.75000000 0.12450680 1.0 Os Os10 1 0.50005005 0.25000000 0.37523361 1.0 Os Os11 1 0.99975842 0.25000000 0.37526910 1.0 Os Os12 1 0.99989114 0.75000000 0.62548928 1.0 Ru Ru13 1 0.50016729 0.75000000 0.62544416 1.0 Ru Ru14 1 0.00033567 0.25000000 0.87473820 1.0 Ru Ru15 1 0.49987967 0.25000000 0.87483930 1.0