# generated using pymatgen data_Sc8Tc(B8Rh)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.47889942 _cell_length_b 8.89116751 _cell_length_c 11.18851277 _cell_angle_alpha 90.13474219 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8Tc(B8Rh)3 _chemical_formula_sum 'Sc8 Tc1 B24 Rh3' _cell_volume 346.07627417 _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 0.94636871 0.37283217 1.0 Sc Sc1 1 0.00000000 0.05586862 0.62651788 1.0 Sc Sc2 1 0.00000000 0.55649666 0.87365216 1.0 Sc Sc3 1 0.00000000 0.18216432 0.91829599 1.0 Sc Sc4 1 0.00000000 0.82215626 0.08697355 1.0 Sc Sc5 1 0.00000000 0.68211722 0.58567060 1.0 Sc Sc6 1 0.00000000 0.31349116 0.40987050 1.0 Sc Sc7 1 0.00000000 0.44191041 0.12581879 1.0 Tc Tc8 1 0.00000000 0.13880999 0.17982147 1.0 B B9 1 0.50000000 0.37012527 0.81842051 1.0 B B10 1 0.50000000 0.97918792 0.21311665 1.0 B B11 1 0.50000000 0.55331577 0.43576008 1.0 B B12 1 0.50000000 0.29490716 0.23645860 1.0 B B13 1 0.50000000 0.20568589 0.73760302 1.0 B B14 1 0.50000000 0.10230222 0.47278612 1.0 B B15 1 0.50000000 0.79416901 0.26390309 1.0 B B16 1 0.50000000 0.44555649 0.56372207 1.0 B B17 1 0.50000000 0.24744485 0.57818751 1.0 B B18 1 0.50000000 0.47998594 0.28692528 1.0 B B19 1 0.50000000 0.70513869 0.76265500 1.0 B B20 1 0.50000000 0.75169643 0.42187172 1.0 B B21 1 0.50000000 0.52058712 0.71263963 1.0 B B22 1 0.50000000 0.89652022 0.52854538 1.0 B B23 1 0.50000000 0.05332532 0.06452105 1.0 B B24 1 0.50000000 0.60421439 0.02787583 1.0 B B25 1 0.50000000 0.74829384 0.92191523 1.0 B B26 1 0.50000000 0.02096339 0.78726559 1.0 B B27 1 0.50000000 0.39807648 0.97126692 1.0 B B28 1 0.50000000 0.94649326 0.93533010 1.0 B B29 1 0.50000000 0.63065483 0.18166714 1.0 B B30 1 0.50000000 0.25194771 0.07886028 1.0 B B31 1 0.50000000 0.86916761 0.68158344 1.0 B B32 1 0.50000000 0.13006772 0.31759531 1.0 Rh Rh33 1 0.00000000 0.36037652 0.67931614 1.0 Rh Rh34 1 0.00000000 0.86122427 0.82057092 1.0 Rh Rh35 1 0.00000000 0.63919030 0.32018426 1.0