# generated using pymatgen data_Lu8Tc(B8Ir)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.58434948 _cell_length_b 9.02905638 _cell_length_c 11.37104160 _cell_angle_alpha 89.88053582 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu8Tc(B8Ir)3 _chemical_formula_sum 'Lu8 Tc1 B24 Ir3' _cell_volume 368.00355703 _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 Lu Lu0 1 0.00000000 0.32430752 0.41263727 1.0 Lu Lu1 1 0.00000000 0.68010188 0.58162938 1.0 Lu Lu2 1 0.00000000 0.81462732 0.09080159 1.0 Lu Lu3 1 0.00000000 0.18069405 0.91416102 1.0 Lu Lu4 1 0.00000000 0.94140703 0.37495495 1.0 Lu Lu5 1 0.00000000 0.05635061 0.62531449 1.0 Lu Lu6 1 0.00000000 0.44687544 0.12677033 1.0 Lu Lu7 1 0.00000000 0.55617224 0.87417350 1.0 Tc Tc8 1 0.00000000 0.63769470 0.32077850 1.0 B B9 1 0.50000000 0.55309827 0.43401262 1.0 B B10 1 0.50000000 0.44693139 0.56550538 1.0 B B11 1 0.50000000 0.05284461 0.06558607 1.0 B B12 1 0.50000000 0.94586460 0.93534170 1.0 B B13 1 0.50000000 0.74876834 0.42007595 1.0 B B14 1 0.50000000 0.25065320 0.57822816 1.0 B B15 1 0.50000000 0.25018965 0.07875616 1.0 B B16 1 0.50000000 0.74946390 0.92155876 1.0 B B17 1 0.50000000 0.79268482 0.26545304 1.0 B B18 1 0.50000000 0.20666983 0.73566135 1.0 B B19 1 0.50000000 0.29282917 0.23426713 1.0 B B20 1 0.50000000 0.70736042 0.76424907 1.0 B B21 1 0.50000000 0.63096651 0.18472863 1.0 B B22 1 0.50000000 0.36815015 0.81700412 1.0 B B23 1 0.50000000 0.13144011 0.31651131 1.0 B B24 1 0.50000000 0.86911259 0.68298455 1.0 B B25 1 0.50000000 0.98074391 0.21380155 1.0 B B26 1 0.50000000 0.01952167 0.78663379 1.0 B B27 1 0.50000000 0.48112948 0.28665045 1.0 B B28 1 0.50000000 0.51982085 0.71298863 1.0 B B29 1 0.50000000 0.60708534 0.02868078 1.0 B B30 1 0.50000000 0.39216717 0.96989954 1.0 B B31 1 0.50000000 0.10903342 0.47038812 1.0 B B32 1 0.50000000 0.89295613 0.53046648 1.0 Ir Ir33 1 0.00000000 0.36216657 0.67907050 1.0 Ir Ir34 1 0.00000000 0.13750789 0.17832352 1.0 Ir Ir35 1 0.00000000 0.86260619 0.82195161 1.0