# generated using pymatgen data_Sc8Be(B8Rh)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.43191049 _cell_length_b 8.88319852 _cell_length_c 11.17442927 _cell_angle_alpha 89.95183936 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8Be(B8Rh)3 _chemical_formula_sum 'Sc8 Be1 B24 Rh3' _cell_volume 340.66735401 _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 0.94786728 0.37027329 1.0 Sc Sc1 1 0.00000000 0.05576027 0.62694430 1.0 Sc Sc2 1 0.00000000 0.55624318 0.87406925 1.0 Sc Sc3 1 0.00000000 0.17932129 0.92074278 1.0 Sc Sc4 1 0.00000000 0.82617957 0.08779403 1.0 Sc Sc5 1 0.00000000 0.68085552 0.58375567 1.0 Sc Sc6 1 0.00000000 0.31448309 0.40915737 1.0 Sc Sc7 1 0.00000000 0.44006348 0.12814746 1.0 Be Be8 1 0.00000000 0.13767015 0.17894885 1.0 B B9 1 0.50000000 0.36722075 0.81979973 1.0 B B10 1 0.50000000 0.98232261 0.21143877 1.0 B B11 1 0.50000000 0.55369373 0.43482474 1.0 B B12 1 0.50000000 0.29547559 0.23770922 1.0 B B13 1 0.50000000 0.20408389 0.73794657 1.0 B B14 1 0.50000000 0.10339116 0.47114817 1.0 B B15 1 0.50000000 0.79767350 0.26177796 1.0 B B16 1 0.50000000 0.44617408 0.56358496 1.0 B B17 1 0.50000000 0.24812361 0.57714650 1.0 B B18 1 0.50000000 0.47826685 0.28702008 1.0 B B19 1 0.50000000 0.70436952 0.76168488 1.0 B B20 1 0.50000000 0.75448378 0.41997109 1.0 B B21 1 0.50000000 0.51959166 0.71330701 1.0 B B22 1 0.50000000 0.89892301 0.52694844 1.0 B B23 1 0.50000000 0.05385079 0.06559076 1.0 B B24 1 0.50000000 0.60153971 0.02829415 1.0 B B25 1 0.50000000 0.74898779 0.92329134 1.0 B B26 1 0.50000000 0.01949619 0.78826550 1.0 B B27 1 0.50000000 0.39575499 0.97312525 1.0 B B28 1 0.50000000 0.94740901 0.93761450 1.0 B B29 1 0.50000000 0.63099841 0.18223254 1.0 B B30 1 0.50000000 0.25034896 0.08034351 1.0 B B31 1 0.50000000 0.86786430 0.68026136 1.0 B B32 1 0.50000000 0.13222740 0.31743779 1.0 Rh Rh33 1 0.00000000 0.35978519 0.68043194 1.0 Rh Rh34 1 0.00000000 0.85779835 0.81808347 1.0 Rh Rh35 1 0.00000000 0.64170533 0.32088676 1.0