# generated using pymatgen data_Sc8Cr(B8Rh)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.44325030 _cell_length_b 8.89100641 _cell_length_c 11.19361938 _cell_angle_alpha 89.90015953 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8Cr(B8Rh)3 _chemical_formula_sum 'Sc8 Cr1 B24 Rh3' _cell_volume 342.68050124 _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 0.81812518 0.08502565 1.0 Sc Sc1 1 0.00000000 0.18580769 0.91070966 1.0 Sc Sc2 1 0.00000000 0.31837208 0.41888503 1.0 Sc Sc3 1 0.00000000 0.67749433 0.58700443 1.0 Sc Sc4 1 0.00000000 0.44402083 0.12638347 1.0 Sc Sc5 1 0.00000000 0.55307720 0.87226785 1.0 Sc Sc6 1 0.00000000 0.94352073 0.37381176 1.0 Sc Sc7 1 0.00000000 0.05826470 0.62582688 1.0 Cr Cr8 1 0.00000000 0.36075238 0.68007765 1.0 B B9 1 0.50000000 0.05402004 0.06357722 1.0 B B10 1 0.50000000 0.94708553 0.93532047 1.0 B B11 1 0.50000000 0.55293823 0.43610778 1.0 B B12 1 0.50000000 0.44674578 0.56540274 1.0 B B13 1 0.50000000 0.25215762 0.07755015 1.0 B B14 1 0.50000000 0.74781782 0.92137385 1.0 B B15 1 0.50000000 0.75113195 0.42230055 1.0 B B16 1 0.50000000 0.24897326 0.57955291 1.0 B B17 1 0.50000000 0.29450365 0.23763630 1.0 B B18 1 0.50000000 0.70497810 0.76354787 1.0 B B19 1 0.50000000 0.79507596 0.26258170 1.0 B B20 1 0.50000000 0.20583302 0.73604948 1.0 B B21 1 0.50000000 0.13056184 0.31886599 1.0 B B22 1 0.50000000 0.86926854 0.68194258 1.0 B B23 1 0.50000000 0.63110248 0.18145326 1.0 B B24 1 0.50000000 0.36965044 0.81671258 1.0 B B25 1 0.50000000 0.47898237 0.28760585 1.0 B B26 1 0.50000000 0.52011158 0.71247581 1.0 B B27 1 0.50000000 0.97937052 0.21290591 1.0 B B28 1 0.50000000 0.02111740 0.78699157 1.0 B B29 1 0.50000000 0.10271085 0.47153009 1.0 B B30 1 0.50000000 0.89606862 0.52814636 1.0 B B31 1 0.50000000 0.60345140 0.02834679 1.0 B B32 1 0.50000000 0.39712737 0.97220013 1.0 Rh Rh33 1 0.00000000 0.13984800 0.17969165 1.0 Rh Rh34 1 0.00000000 0.86062840 0.82003433 1.0 Rh Rh35 1 0.00000000 0.63930210 0.32010468 1.0