# generated using pymatgen data_Er8Re(B8Ru)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.63230959 _cell_length_b 9.07725159 _cell_length_c 11.45107055 _cell_angle_alpha 90.13095221 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er8Re(B8Ru)3 _chemical_formula_sum 'Er8 Re1 B24 Ru3' _cell_volume 377.55670424 _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 Er Er0 1 0.00000000 0.32280151 0.41540927 1.0 Er Er1 1 0.00000000 0.68070946 0.58855041 1.0 Er Er2 1 0.00000000 0.82248523 0.08279067 1.0 Er Er3 1 0.00000000 0.17568855 0.91350441 1.0 Er Er4 1 0.00000000 0.94303815 0.37096393 1.0 Er Er5 1 0.00000000 0.05647303 0.62778555 1.0 Er Er6 1 0.00000000 0.44235790 0.12872124 1.0 Er Er7 1 0.00000000 0.55636290 0.87239861 1.0 Re Re8 1 0.00000000 0.86252824 0.82086410 1.0 B B9 1 0.50000000 0.55406425 0.43352765 1.0 B B10 1 0.50000000 0.44668687 0.56698143 1.0 B B11 1 0.50000000 0.05353437 0.06727813 1.0 B B12 1 0.50000000 0.94718603 0.93352323 1.0 B B13 1 0.50000000 0.74834186 0.41967061 1.0 B B14 1 0.50000000 0.25227255 0.57992387 1.0 B B15 1 0.50000000 0.24759204 0.08057324 1.0 B B16 1 0.50000000 0.75156835 0.91961023 1.0 B B17 1 0.50000000 0.79032581 0.26555974 1.0 B B18 1 0.50000000 0.20927644 0.73333886 1.0 B B19 1 0.50000000 0.29081628 0.23448041 1.0 B B20 1 0.50000000 0.70820090 0.76575335 1.0 B B21 1 0.50000000 0.63064045 0.18519653 1.0 B B22 1 0.50000000 0.36855673 0.81443211 1.0 B B23 1 0.50000000 0.13136902 0.31492039 1.0 B B24 1 0.50000000 0.86912769 0.68519200 1.0 B B25 1 0.50000000 0.98267235 0.21248936 1.0 B B26 1 0.50000000 0.01859079 0.78718901 1.0 B B27 1 0.50000000 0.48260088 0.28798194 1.0 B B28 1 0.50000000 0.51743319 0.71265424 1.0 B B29 1 0.50000000 0.60528953 0.03013971 1.0 B B30 1 0.50000000 0.39246062 0.97076675 1.0 B B31 1 0.50000000 0.10735004 0.46978156 1.0 B B32 1 0.50000000 0.89377498 0.52868654 1.0 Ru Ru33 1 0.00000000 0.63728534 0.32113827 1.0 Ru Ru34 1 0.00000000 0.36265926 0.67850065 1.0 Ru Ru35 1 0.00000000 0.13788041 0.17971900 1.0