# generated using pymatgen data_Sc4TcB12Rh _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.49632688 _cell_length_b 8.87134020 _cell_length_c 11.18255478 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4TcB12Rh _chemical_formula_sum 'Sc8 Tc2 B24 Rh2' _cell_volume 346.85047778 _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 0.00000000 0.94573016 0.37264501 1.0 Sc Sc1 1 0.00000000 0.05814396 0.62624428 1.0 Sc Sc2 1 0.00000000 0.55426984 0.87264501 1.0 Sc Sc3 1 0.00000000 0.18777585 0.91433861 1.0 Sc Sc4 1 0.00000000 0.82352312 0.08645900 1.0 Sc Sc5 1 0.00000000 0.67647688 0.58645900 1.0 Sc Sc6 1 0.00000000 0.31222415 0.41433861 1.0 Sc Sc7 1 0.00000000 0.44185604 0.12624428 1.0 Tc Tc8 1 0.00000000 0.13810548 0.17946836 1.0 Tc Tc9 1 0.00000000 0.36189452 0.67946836 1.0 B B10 1 0.50000000 0.37063705 0.81748672 1.0 B B11 1 0.50000000 0.97884743 0.21240085 1.0 B B12 1 0.50000000 0.55334992 0.43488272 1.0 B B13 1 0.50000000 0.29428623 0.23676680 1.0 B B14 1 0.50000000 0.20571377 0.73676680 1.0 B B15 1 0.50000000 0.10002619 0.47235930 1.0 B B16 1 0.50000000 0.79373132 0.26413112 1.0 B B17 1 0.50000000 0.44664135 0.56421443 1.0 B B18 1 0.50000000 0.24760643 0.57901325 1.0 B B19 1 0.50000000 0.47976625 0.28701666 1.0 B B20 1 0.50000000 0.70626868 0.76413112 1.0 B B21 1 0.50000000 0.75144126 0.42212429 1.0 B B22 1 0.50000000 0.52115257 0.71240085 1.0 B B23 1 0.50000000 0.89596364 0.52828891 1.0 B B24 1 0.50000000 0.05335865 0.06421443 1.0 B B25 1 0.50000000 0.60403636 0.02828891 1.0 B B26 1 0.50000000 0.74855874 0.92212429 1.0 B B27 1 0.50000000 0.02023375 0.78701666 1.0 B B28 1 0.50000000 0.39997381 0.97235930 1.0 B B29 1 0.50000000 0.94665008 0.93488272 1.0 B B30 1 0.50000000 0.63068485 0.18180050 1.0 B B31 1 0.50000000 0.25239357 0.07901325 1.0 B B32 1 0.50000000 0.86931515 0.68180050 1.0 B B33 1 0.50000000 0.12936295 0.31748672 1.0 Rh Rh34 1 0.00000000 0.86120817 0.82035921 1.0 Rh Rh35 1 0.00000000 0.63879183 0.32035921 1.0