# generated using pymatgen data_ScTaBe4Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.15004686 _cell_length_b 8.56707040 _cell_length_c 10.05916277 _cell_angle_alpha 90.33356872 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ScTaBe4Ru5 _chemical_formula_sum 'Sc2 Ta2 Be8 Ru10' _cell_volume 271.45873825 _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 Sc Sc0 1 0.50000000 0.66034360 0.67949445 1.0 Sc Sc1 1 0.50000000 0.33965640 0.32050555 1.0 Ta Ta2 1 0.50000000 0.84227999 0.18297817 1.0 Ta Ta3 1 0.50000000 0.15772001 0.81702183 1.0 Be Be4 1 0.50000000 0.96456546 0.59425069 1.0 Be Be5 1 0.50000000 0.03543454 0.40574931 1.0 Be Be6 1 0.50000000 0.84328295 0.90417427 1.0 Be Be7 1 0.50000000 0.15671705 0.09582573 1.0 Be Be8 1 0.50000000 0.65940926 0.40471619 1.0 Be Be9 1 0.50000000 0.34059074 0.59528381 1.0 Be Be10 1 0.50000000 0.46466213 0.90522810 1.0 Be Be11 1 0.50000000 0.53533787 0.09477190 1.0 Ru Ru12 1 0.00000000 0.66122246 0.95627820 1.0 Ru Ru13 1 0.00000000 0.33877754 0.04372180 1.0 Ru Ru14 1 0.00000000 0.84272268 0.44943414 1.0 Ru Ru15 1 0.00000000 0.15727732 0.55056586 1.0 Ru Ru16 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru17 1 0.00000000 0.39427111 0.75854107 1.0 Ru Ru18 1 0.00000000 0.60572889 0.24145893 1.0 Ru Ru19 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru20 1 0.00000000 0.91133477 0.74343921 1.0 Ru Ru21 1 0.00000000 0.08866523 0.25656079 1.0