# generated using pymatgen data_Ti5Si _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.73993743 _cell_length_b 5.04469900 _cell_length_c 5.31181392 _cell_angle_alpha 90.00000000 _cell_angle_beta 123.27540409 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti5Si _chemical_formula_sum 'Ti10 Si2' _cell_volume 195.80105770 _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 0.34835800 0.96635400 0.04568100 1.0 Ti Ti1 1 0.69743500 0.76904000 0.50001800 1.0 Ti Ti2 1 0.30256500 0.76904000 0.49998200 1.0 Ti Ti3 1 0.15164200 0.46635400 0.95431900 1.0 Ti Ti4 1 0.00000000 0.86164800 0.50000000 1.0 Ti Ti5 1 0.84835800 0.46635400 0.04568100 1.0 Ti Ti6 1 0.19743500 0.26904000 0.50001800 1.0 Ti Ti7 1 0.80256500 0.26904000 0.49998200 1.0 Ti Ti8 1 0.65164200 0.96635400 0.95431900 1.0 Ti Ti9 1 0.50000000 0.36164800 0.50000000 1.0 Si Si10 1 0.00000000 0.96605300 0.00000000 1.0 Si Si11 1 0.50000000 0.46605300 0.00000000 1.0