# generated using pymatgen data_Lu4TcB12Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.59105745 _cell_length_b 9.00971443 _cell_length_c 11.37183658 _cell_angle_alpha 89.83463431 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu4TcB12Ru _chemical_formula_sum 'Lu8 Tc2 B24 Ru2' _cell_volume 367.92744075 _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 Lu Lu0 1 0.00000000 0.32494220 0.41635345 1.0 Lu Lu1 1 0.00000000 0.67505780 0.58364655 1.0 Lu Lu2 1 0.00000000 0.81989223 0.08720009 1.0 Lu Lu3 1 0.00000000 0.18010777 0.91279991 1.0 Lu Lu4 1 0.00000000 0.94199869 0.37085539 1.0 Lu Lu5 1 0.00000000 0.05800131 0.62914461 1.0 Lu Lu6 1 0.00000000 0.44328634 0.12969922 1.0 Lu Lu7 1 0.00000000 0.55671366 0.87030078 1.0 Tc Tc8 1 0.00000000 0.63792998 0.32006413 1.0 Tc Tc9 1 0.00000000 0.36207002 0.67993587 1.0 B B10 1 0.50000000 0.55289054 0.43359470 1.0 B B11 1 0.50000000 0.44710946 0.56640530 1.0 B B12 1 0.50000000 0.05350008 0.06620870 1.0 B B13 1 0.50000000 0.94649992 0.93379130 1.0 B B14 1 0.50000000 0.74941951 0.41951680 1.0 B B15 1 0.50000000 0.25058049 0.58048320 1.0 B B16 1 0.50000000 0.24942798 0.08046172 1.0 B B17 1 0.50000000 0.75057202 0.91953828 1.0 B B18 1 0.50000000 0.79242105 0.26445995 1.0 B B19 1 0.50000000 0.20757895 0.73554005 1.0 B B20 1 0.50000000 0.29137136 0.23502896 1.0 B B21 1 0.50000000 0.70862864 0.76497104 1.0 B B22 1 0.50000000 0.63063484 0.18433287 1.0 B B23 1 0.50000000 0.36936516 0.81566713 1.0 B B24 1 0.50000000 0.13017944 0.31504474 1.0 B B25 1 0.50000000 0.86982056 0.68495526 1.0 B B26 1 0.50000000 0.98141460 0.21193857 1.0 B B27 1 0.50000000 0.01858540 0.78806143 1.0 B B28 1 0.50000000 0.48075614 0.28759928 1.0 B B29 1 0.50000000 0.51924386 0.71240072 1.0 B B30 1 0.50000000 0.60256548 0.02812885 1.0 B B31 1 0.50000000 0.39743452 0.97187115 1.0 B B32 1 0.50000000 0.10213152 0.47147957 1.0 B B33 1 0.50000000 0.89786848 0.52852043 1.0 Ru Ru34 1 0.00000000 0.13758934 0.17864356 1.0 Ru Ru35 1 0.00000000 0.86241066 0.82135644 1.0