# generated using pymatgen data_Sc8Cr(B8Os)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.46881424 _cell_length_b 8.87007414 _cell_length_c 11.18456096 _cell_angle_alpha 89.98968522 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8Cr(B8Os)3 _chemical_formula_sum 'Sc8 Cr1 B24 Os3' _cell_volume 344.13371798 _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 Sc Sc0 1 0.00000000 0.81884041 0.08453251 1.0 Sc Sc1 1 0.00000000 0.18265887 0.91250302 1.0 Sc Sc2 1 0.00000000 0.31954447 0.41726397 1.0 Sc Sc3 1 0.00000000 0.67888391 0.58689397 1.0 Sc Sc4 1 0.00000000 0.44380725 0.12715406 1.0 Sc Sc5 1 0.00000000 0.55482756 0.87159529 1.0 Sc Sc6 1 0.00000000 0.94351807 0.37331752 1.0 Sc Sc7 1 0.00000000 0.05733721 0.62735383 1.0 Cr Cr8 1 0.00000000 0.36130261 0.67983896 1.0 B B9 1 0.50000000 0.05316206 0.06473298 1.0 B B10 1 0.50000000 0.94695633 0.93474088 1.0 B B11 1 0.50000000 0.55288179 0.43537081 1.0 B B12 1 0.50000000 0.44701682 0.56573882 1.0 B B13 1 0.50000000 0.25159058 0.07827929 1.0 B B14 1 0.50000000 0.74761894 0.92070959 1.0 B B15 1 0.50000000 0.75112521 0.42172458 1.0 B B16 1 0.50000000 0.24921341 0.57942612 1.0 B B17 1 0.50000000 0.29370777 0.23591523 1.0 B B18 1 0.50000000 0.70578847 0.76399920 1.0 B B19 1 0.50000000 0.79387235 0.26426243 1.0 B B20 1 0.50000000 0.20667197 0.73547737 1.0 B B21 1 0.50000000 0.13018519 0.31772909 1.0 B B22 1 0.50000000 0.87035522 0.68305422 1.0 B B23 1 0.50000000 0.63006170 0.18233136 1.0 B B24 1 0.50000000 0.37014791 0.81643158 1.0 B B25 1 0.50000000 0.47927178 0.28753867 1.0 B B26 1 0.50000000 0.52038887 0.71219631 1.0 B B27 1 0.50000000 0.97930370 0.21267193 1.0 B B28 1 0.50000000 0.02120918 0.78705006 1.0 B B29 1 0.50000000 0.10200778 0.47210837 1.0 B B30 1 0.50000000 0.89817446 0.52830579 1.0 B B31 1 0.50000000 0.60136235 0.02773464 1.0 B B32 1 0.50000000 0.39824597 0.97176261 1.0 Os Os33 1 0.00000000 0.13821204 0.17955997 1.0 Os Os34 1 0.00000000 0.86159266 0.82125839 1.0 Os Os35 1 0.00000000 0.63915415 0.31943557 1.0