# generated using pymatgen data_Ti2FeB2Ru3Rh2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.96544500 _cell_length_b 9.10841745 _cell_length_c 9.15723041 _cell_angle_alpha 90.17316536 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti2FeB2Ru3Rh2 _chemical_formula_sum 'Ti4 Fe2 B4 Ru6 Rh4' _cell_volume 247.34034281 _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 Ti Ti0 1 0.00000000 0.17648200 0.68207800 1.0 Ti Ti1 1 0.00000000 0.82351800 0.31792200 1.0 Ti Ti2 1 0.00000000 0.32176200 0.17388500 1.0 Ti Ti3 1 0.00000000 0.67823800 0.82611500 1.0 Fe Fe4 1 0.00000000 0.50000000 0.50000000 1.0 Fe Fe5 1 0.00000000 0.00000000 0.00000000 1.0 B B6 1 0.00000000 0.62580800 0.12651000 1.0 B B7 1 0.00000000 0.37419200 0.87349000 1.0 B B8 1 0.00000000 0.87587000 0.62709900 1.0 B B9 1 0.00000000 0.12413000 0.37290100 1.0 Ru Ru10 1 0.50000000 0.78719600 0.07274800 1.0 Ru Ru11 1 0.50000000 0.21280400 0.92725200 1.0 Ru Ru12 1 0.50000000 0.57196300 0.28752600 1.0 Ru Ru13 1 0.50000000 0.42803700 0.71247400 1.0 Ru Ru14 1 0.50000000 0.07333300 0.21322500 1.0 Ru Ru15 1 0.50000000 0.92666700 0.78677500 1.0 Rh Rh16 1 0.50000000 0.00000000 0.50000000 1.0 Rh Rh17 1 0.50000000 0.50000000 0.00000000 1.0 Rh Rh18 1 0.50000000 0.71518800 0.57252000 1.0 Rh Rh19 1 0.50000000 0.28481200 0.42748000 1.0