# generated using pymatgen data_Sc4B12IrRh _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.91393889 _cell_length_b 11.20107097 _cell_length_c 3.46307989 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.93997920 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4B12IrRh _chemical_formula_sum 'Sc8 B24 Ir2 Rh2' _cell_volume 345.77331481 _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 0.68351405 0.58637583 0.00000000 1.0 Sc Sc1 1 0.31648595 0.41362417 0.00000000 1.0 Sc Sc2 1 0.18038699 0.91509080 0.00000000 1.0 Sc Sc3 1 0.81961201 0.08490920 0.00000000 1.0 Sc Sc4 1 0.05528646 0.62585699 0.00000000 1.0 Sc Sc5 1 0.94471354 0.37414301 0.00000000 1.0 Sc Sc6 1 0.55615376 0.87477075 0.00000000 1.0 Sc Sc7 1 0.44384624 0.12522925 0.00000000 1.0 B B8 1 0.24717464 0.57800680 0.49999900 1.0 B B9 1 0.75282536 0.42199320 0.49999900 1.0 B B10 1 0.74826868 0.92187274 0.49999900 1.0 B B11 1 0.25173132 0.07812826 0.49999900 1.0 B B12 1 0.02004617 0.78717684 0.49999900 1.0 B B13 1 0.97995383 0.21282316 0.49999900 1.0 B B14 1 0.52053444 0.71343958 0.49999900 1.0 B B15 1 0.47946556 0.28655942 0.49999900 1.0 B B16 1 0.20413788 0.73739364 0.49999900 1.0 B B17 1 0.79586112 0.26260736 0.49999900 1.0 B B18 1 0.70447621 0.76252956 0.49999900 1.0 B B19 1 0.29552479 0.23747044 0.49999900 1.0 B B20 1 0.44581968 0.56366399 0.49999900 1.0 B B21 1 0.55418032 0.43633401 0.49999900 1.0 B B22 1 0.94624024 0.93632547 0.49999900 1.0 B B23 1 0.05375876 0.06367453 0.49999900 1.0 B B24 1 0.39623319 0.97193090 0.49999900 1.0 B B25 1 0.60376781 0.02806810 0.49999900 1.0 B B26 1 0.89661392 0.52809212 0.49999900 1.0 B B27 1 0.86879560 0.68136829 0.49999900 1.0 B B28 1 0.13120440 0.31862971 0.49999900 1.0 B B29 1 0.10338608 0.47190788 0.49999900 1.0 B B30 1 0.36882615 0.81875987 0.49999900 1.0 B B31 1 0.63117185 0.18124013 0.49999900 1.0 Ir Ir32 1 0.36032844 0.67934323 0.00000000 1.0 Ir Ir33 1 0.63967156 0.32065777 0.00000000 1.0 Rh Rh34 1 0.85909166 0.81890077 0.00000000 1.0 Rh Rh35 1 0.14090834 0.18109923 0.00000000 1.0