# generated using pymatgen data_LuScB6Os _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.53667796 _cell_length_b 8.90708433 _cell_length_c 11.25550149 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LuScB6Os _chemical_formula_sum 'Lu4 Sc4 B24 Os4' _cell_volume 354.56505457 _cell_formula_units_Z 4 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 Lu Lu0 1 0.50000000 0.31886472 0.41393030 1.0 Lu Lu1 1 0.50000000 0.68113528 0.58606970 1.0 Lu Lu2 1 0.50000000 0.18113528 0.91393030 1.0 Lu Lu3 1 0.50000000 0.81886472 0.08606970 1.0 Sc Sc4 1 0.50000000 0.44497728 0.12559111 1.0 Sc Sc5 1 0.50000000 0.55502272 0.87440889 1.0 Sc Sc6 1 0.50000000 0.05502272 0.62559111 1.0 Sc Sc7 1 0.50000000 0.94497728 0.37440889 1.0 B B8 1 0.00000000 0.10170442 0.47230073 1.0 B B9 1 0.00000000 0.89829558 0.52769927 1.0 B B10 1 0.00000000 0.39829558 0.97230073 1.0 B B11 1 0.00000000 0.60170442 0.02769927 1.0 B B12 1 0.00000000 0.12958167 0.31740038 1.0 B B13 1 0.00000000 0.87041833 0.68259962 1.0 B B14 1 0.00000000 0.37041833 0.81740038 1.0 B B15 1 0.00000000 0.62958167 0.18259962 1.0 B B16 1 0.00000000 0.05415295 0.06620507 1.0 B B17 1 0.00000000 0.94584705 0.93379493 1.0 B B18 1 0.00000000 0.44584705 0.56620507 1.0 B B19 1 0.00000000 0.55415295 0.43379493 1.0 B B20 1 0.00000000 0.48083790 0.28603773 1.0 B B21 1 0.00000000 0.51916210 0.71396227 1.0 B B22 1 0.00000000 0.01916210 0.78603773 1.0 B B23 1 0.00000000 0.98083790 0.21396227 1.0 B B24 1 0.00000000 0.25210362 0.08005348 1.0 B B25 1 0.00000000 0.74789638 0.91994652 1.0 B B26 1 0.00000000 0.24789638 0.58005348 1.0 B B27 1 0.00000000 0.75210362 0.41994652 1.0 B B28 1 0.00000000 0.29330514 0.23513795 1.0 B B29 1 0.00000000 0.70669486 0.76486205 1.0 B B30 1 0.00000000 0.20669486 0.73513795 1.0 B B31 1 0.00000000 0.79330514 0.26486205 1.0 Os Os32 1 0.50000000 0.13880914 0.18025997 1.0 Os Os33 1 0.50000000 0.86119086 0.81974003 1.0 Os Os34 1 0.50000000 0.36119086 0.68025997 1.0 Os Os35 1 0.50000000 0.63880914 0.31974003 1.0