# generated using pymatgen data_Mg3Sc5(B6Os)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.48524122 _cell_length_b 8.81699986 _cell_length_c 11.10279229 _cell_angle_alpha 90.11815126 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg3Sc5(B6Os)4 _chemical_formula_sum 'Mg3 Sc5 B24 Os4' _cell_volume 341.18110215 _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 Mg Mg0 1 0.00000000 0.94469679 0.37361013 1.0 Mg Mg1 1 0.00000000 0.05590206 0.62722062 1.0 Mg Mg2 1 0.00000000 0.55473280 0.87490285 1.0 Sc Sc3 1 0.00000000 0.17861274 0.91368043 1.0 Sc Sc4 1 0.00000000 0.82006682 0.08217794 1.0 Sc Sc5 1 0.00000000 0.67306652 0.58940192 1.0 Sc Sc6 1 0.00000000 0.32602425 0.41488637 1.0 Sc Sc7 1 0.00000000 0.44418266 0.12691376 1.0 B B8 1 0.50000000 0.37086275 0.81713187 1.0 B B9 1 0.50000000 0.97837683 0.21248069 1.0 B B10 1 0.50000000 0.55526881 0.43548107 1.0 B B11 1 0.50000000 0.29339183 0.23698410 1.0 B B12 1 0.50000000 0.20613455 0.73692820 1.0 B B13 1 0.50000000 0.09416281 0.47411938 1.0 B B14 1 0.50000000 0.79509907 0.26306596 1.0 B B15 1 0.50000000 0.44531654 0.56517839 1.0 B B16 1 0.50000000 0.24437553 0.57851821 1.0 B B17 1 0.50000000 0.48056713 0.28747779 1.0 B B18 1 0.50000000 0.70610509 0.76261626 1.0 B B19 1 0.50000000 0.75587692 0.42176330 1.0 B B20 1 0.50000000 0.52019306 0.71295491 1.0 B B21 1 0.50000000 0.90564328 0.52635029 1.0 B B22 1 0.50000000 0.05298557 0.06558223 1.0 B B23 1 0.50000000 0.60041627 0.02652662 1.0 B B24 1 0.50000000 0.74659186 0.91943465 1.0 B B25 1 0.50000000 0.02189334 0.78737729 1.0 B B26 1 0.50000000 0.40024952 0.97168289 1.0 B B27 1 0.50000000 0.94614859 0.93372524 1.0 B B28 1 0.50000000 0.63092268 0.18224641 1.0 B B29 1 0.50000000 0.25228215 0.07885388 1.0 B B30 1 0.50000000 0.87157825 0.68109345 1.0 B B31 1 0.50000000 0.12790790 0.31932974 1.0 Os Os32 1 0.00000000 0.13821148 0.18142162 1.0 Os Os33 1 0.00000000 0.36074154 0.67768091 1.0 Os Os34 1 0.00000000 0.86135167 0.81884308 1.0 Os Os35 1 0.00000000 0.64005532 0.32236257 1.0