# generated using pymatgen data_Lu2Tc2B4Ru3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.05746804 _cell_length_b 8.63886117 _cell_length_c 10.05905125 _cell_angle_alpha 90.00382662 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu2Tc2B4Ru3 _chemical_formula_sum 'Lu4 Tc4 B8 Ru6' _cell_volume 265.69014230 _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 0.50000000 0.84097400 0.18211420 1.0 Lu Lu1 1 0.50000000 0.15902600 0.81788580 1.0 Lu Lu2 1 0.50000000 0.65901284 0.68210316 1.0 Lu Lu3 1 0.50000000 0.34098716 0.31789684 1.0 Tc Tc4 1 0.00000000 0.65844459 0.95386594 1.0 Tc Tc5 1 0.00000000 0.34155541 0.04613406 1.0 Tc Tc6 1 0.00000000 0.84153232 0.45383304 1.0 Tc Tc7 1 0.00000000 0.15846768 0.54616696 1.0 B B8 1 0.50000000 0.96630394 0.58769758 1.0 B B9 1 0.50000000 0.03369606 0.41230242 1.0 B B10 1 0.50000000 0.84857511 0.90166681 1.0 B B11 1 0.50000000 0.15142489 0.09833319 1.0 B B12 1 0.50000000 0.65141026 0.40168455 1.0 B B13 1 0.50000000 0.34858974 0.59831545 1.0 B B14 1 0.50000000 0.46630658 0.91228743 1.0 B B15 1 0.50000000 0.53369342 0.08771257 1.0 Ru Ru16 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru17 1 0.00000000 0.40565609 0.76020277 1.0 Ru Ru18 1 0.00000000 0.59434391 0.23979723 1.0 Ru Ru19 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru20 1 0.00000000 0.90566620 0.73987354 1.0 Ru Ru21 1 0.00000000 0.09433380 0.26012646 1.0