# generated using pymatgen data_LiSm3Bi(Ru2O7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.46795576 _cell_length_b 7.46695437 _cell_length_c 7.33891613 _cell_angle_alpha 89.98696141 _cell_angle_beta 59.41113777 _cell_angle_gamma 119.97691469 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiSm3Bi(Ru2O7)2 _chemical_formula_sum 'Li1 Sm3 Bi1 Ru4 O14' _cell_volume 286.84138353 _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 Li Li0 1 0.27606600 0.63854200 0.08566400 1.0 Sm Sm1 1 0.23969700 0.36157900 0.39896400 1.0 Sm Sm2 1 0.23911100 0.87812400 0.39987700 1.0 Sm Sm3 1 0.72260000 0.36142400 0.39935400 1.0 Bi Bi4 1 0.74689800 0.37297500 0.87966600 1.0 Ru Ru5 1 0.75467400 0.87755500 0.36796000 1.0 Ru Ru6 1 0.24451100 0.87755300 0.87816900 1.0 Ru Ru7 1 0.24460100 0.36751900 0.87812000 1.0 Ru Ru8 1 0.75457100 0.87748400 0.87815000 1.0 O O9 1 0.50158200 0.25078100 0.24775900 1.0 O O10 1 0.03700500 0.51857600 0.44451600 1.0 O O11 1 0.92207800 0.96130400 0.54095100 1.0 O O12 1 0.49807300 0.53724600 0.54082600 1.0 O O13 1 0.49816300 0.96129300 0.54079000 1.0 O O14 1 0.08248800 0.54142400 0.96406200 1.0 O O15 1 0.49476500 0.95377300 0.96412700 1.0 O O16 1 0.49462900 0.54151400 0.96409300 1.0 O O17 1 0.59434700 0.79746200 0.20519100 1.0 O O18 1 0.99756400 0.20067100 0.20527600 1.0 O O19 1 0.99757500 0.79733800 0.20543400 1.0 O O20 1 0.40899300 0.20471700 0.79989100 1.0 O O21 1 0.99547500 0.79140300 0.80020400 1.0 O O22 1 0.99560500 0.20474000 0.79984400 1.0