# generated using pymatgen data_TbEr5(Si3Ru)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.05338299 _cell_length_b 10.05338291 _cell_length_c 8.08648521 _cell_angle_alpha 90.03036614 _cell_angle_beta 89.96963409 _cell_angle_gamma 132.60847020 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbEr5(Si3Ru)8 _chemical_formula_sum 'Tb1 Er5 Si24 Ru8' _cell_volume 601.53406683 _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 Tb Tb0 1 0.49692662 0.99692662 0.25000000 1.0 Er Er1 1 0.00285657 0.50285657 0.75000000 1.0 Er Er2 1 0.50296744 0.00296744 0.75000000 1.0 Er Er3 1 0.99674283 0.49674283 0.25000000 1.0 Er Er4 1 0.49997139 0.49997716 0.50004795 1.0 Er Er5 1 0.99997716 0.99997139 0.99995205 1.0 Si Si6 1 0.38973215 0.15511975 0.00450783 1.0 Si Si7 1 0.65511975 0.88973215 0.49549217 1.0 Si Si8 1 0.10976416 0.34375133 0.50443251 1.0 Si Si9 1 0.84375133 0.60976416 0.99556749 1.0 Si Si10 1 0.61042231 0.84540702 0.99342968 1.0 Si Si11 1 0.34540702 0.11042231 0.50657032 1.0 Si Si12 1 0.89004786 0.65602721 0.49489244 1.0 Si Si13 1 0.15602721 0.39004786 0.00510756 1.0 Si Si14 1 0.61417137 0.37961999 0.22739653 1.0 Si Si15 1 0.87961999 0.11417137 0.27260347 1.0 Si Si16 1 0.88664704 0.12092134 0.72705772 1.0 Si Si17 1 0.62092134 0.38664704 0.77294228 1.0 Si Si18 1 0.38707584 0.62153861 0.77262683 1.0 Si Si19 1 0.12153861 0.88707584 0.72737317 1.0 Si Si20 1 0.70586064 0.29463668 0.99933426 1.0 Si Si21 1 0.79463668 0.20586064 0.50066574 1.0 Si Si22 1 0.29394153 0.70511212 0.99941132 1.0 Si Si23 1 0.20511212 0.79394153 0.50058868 1.0 Si Si24 1 0.16709012 0.16617405 0.33372126 1.0 Si Si25 1 0.66617405 0.66709012 0.16627874 1.0 Si Si26 1 0.33329891 0.33359892 0.83388300 1.0 Si Si27 1 0.83359892 0.83329891 0.66611700 1.0 Si Si28 1 0.37765034 0.61240605 0.22764447 1.0 Si Si29 1 0.11240605 0.87765034 0.27235553 1.0 Ru Ru30 1 0.62706261 0.62728442 0.87266733 1.0 Ru Ru31 1 0.12728442 0.12706261 0.62733267 1.0 Ru Ru32 1 0.87297439 0.87316570 0.37242219 1.0 Ru Ru33 1 0.37316570 0.37297439 0.12757781 1.0 Ru Ru34 1 0.32961460 0.66729013 0.50087965 1.0 Ru Ru35 1 0.16729013 0.82961460 0.99912035 1.0 Ru Ru36 1 0.67038867 0.33276117 0.50076494 1.0 Ru Ru37 1 0.83276117 0.17038867 0.99923506 1.0