# generated using pymatgen data_SmLuB6Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.65319475 _cell_length_b 9.10803526 _cell_length_c 11.51729511 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmLuB6Ru _chemical_formula_sum 'Sm4 Lu4 B24 Ru4' _cell_volume 383.21987317 _cell_formula_units_Z 4 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 Sm Sm0 1 0.00000000 0.32196559 0.41456966 1.0 Sm Sm1 1 0.00000000 0.67803441 0.58543034 1.0 Sm Sm2 1 0.00000000 0.82196559 0.08543034 1.0 Sm Sm3 1 0.00000000 0.17803441 0.91456966 1.0 Lu Lu4 1 0.00000000 0.94449544 0.37244705 1.0 Lu Lu5 1 0.00000000 0.05550456 0.62755295 1.0 Lu Lu6 1 0.00000000 0.44449544 0.12755295 1.0 Lu Lu7 1 0.00000000 0.55550456 0.87244705 1.0 B B8 1 0.50000000 0.55604654 0.43070644 1.0 B B9 1 0.50000000 0.44395346 0.56929356 1.0 B B10 1 0.50000000 0.05604654 0.06929356 1.0 B B11 1 0.50000000 0.94395346 0.93070644 1.0 B B12 1 0.50000000 0.75077505 0.41760314 1.0 B B13 1 0.50000000 0.24922495 0.58239686 1.0 B B14 1 0.50000000 0.25077505 0.08239686 1.0 B B15 1 0.50000000 0.74922495 0.91760314 1.0 B B16 1 0.50000000 0.79143580 0.26605061 1.0 B B17 1 0.50000000 0.20856420 0.73394939 1.0 B B18 1 0.50000000 0.29143580 0.23394939 1.0 B B19 1 0.50000000 0.70856420 0.76605061 1.0 B B20 1 0.50000000 0.63013614 0.18435781 1.0 B B21 1 0.50000000 0.36986386 0.81564219 1.0 B B22 1 0.50000000 0.13013614 0.31564219 1.0 B B23 1 0.50000000 0.86986386 0.68435781 1.0 B B24 1 0.50000000 0.98453905 0.21425443 1.0 B B25 1 0.50000000 0.01546095 0.78574557 1.0 B B26 1 0.50000000 0.48453905 0.28574557 1.0 B B27 1 0.50000000 0.51546095 0.71425443 1.0 B B28 1 0.50000000 0.60261363 0.02781882 1.0 B B29 1 0.50000000 0.39738637 0.97218118 1.0 B B30 1 0.50000000 0.10261363 0.47218118 1.0 B B31 1 0.50000000 0.89738637 0.52781882 1.0 Ru Ru32 1 0.00000000 0.63979678 0.31893138 1.0 Ru Ru33 1 0.00000000 0.36020322 0.68106862 1.0 Ru Ru34 1 0.00000000 0.13979678 0.18106862 1.0 Ru Ru35 1 0.00000000 0.86020322 0.81893138 1.0