# generated using pymatgen data_Sc2SnSbRu4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.50451104 _cell_length_b 6.38104627 _cell_length_c 13.50333962 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00028842 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2SnSbRu4 _chemical_formula_sum 'Sc6 Sn3 Sb3 Ru12' _cell_volume 388.13315287 _cell_formula_units_Z 3 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 Sc Sc0 1 0.00001072 0.00000000 0.00109409 1.0 Sc Sc1 1 0.49994377 0.50000000 0.16667744 1.0 Sc Sc2 1 0.99993619 0.00000000 0.33225065 1.0 Sc Sc3 1 0.49999082 0.50000000 0.49899121 1.0 Sc Sc4 1 0.00004034 0.00000000 0.66665107 1.0 Sc Sc5 1 0.50006187 0.50000000 0.83433959 1.0 Sn Sn6 1 0.00000871 0.50000000 0.00007536 1.0 Sn Sn7 1 0.49994239 0.00000000 0.16671213 1.0 Sn Sn8 1 0.99993492 0.50000000 0.33328752 1.0 Sb Sb9 1 0.49999273 0.00000000 0.49934245 1.0 Sb Sb10 1 0.00004772 0.50000000 0.66666689 1.0 Sb Sb11 1 0.50009069 0.00000000 0.83396713 1.0 Ru Ru12 1 0.50001053 0.24873763 0.99788658 1.0 Ru Ru13 1 0.50001053 0.75126337 0.99788658 1.0 Ru Ru14 1 0.99995037 0.24990613 0.16668680 1.0 Ru Ru15 1 0.99995037 0.75009387 0.16668680 1.0 Ru Ru16 1 0.49994178 0.24874300 0.33545893 1.0 Ru Ru17 1 0.49994178 0.75125800 0.33545893 1.0 Ru Ru18 1 0.99999563 0.24919959 0.50225225 1.0 Ru Ru19 1 0.99999563 0.75079941 0.50225225 1.0 Ru Ru20 1 0.50003929 0.24944043 0.66664045 1.0 Ru Ru21 1 0.50003929 0.75056057 0.66664045 1.0 Ru Ru22 1 0.00006496 0.24917733 0.83104872 1.0 Ru Ru23 1 0.00006496 0.75082267 0.83104872 1.0