# generated using pymatgen data_Ti12AgSn9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.22434206 _cell_length_b 9.22434288 _cell_length_c 5.68757357 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000059 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti12AgSn9 _chemical_formula_sum 'Ti12 Ag1 Sn9' _cell_volume 419.11045342 _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 Ti Ti0 1 0.84353383 0.68706765 0.75810598 1.0 Ti Ti1 1 0.15646617 0.84353383 0.24189402 1.0 Ti Ti2 1 0.68706765 0.84353383 0.24189402 1.0 Ti Ti3 1 0.31293235 0.15646617 0.75810598 1.0 Ti Ti4 1 0.84353383 0.15646617 0.75810598 1.0 Ti Ti5 1 0.15646617 0.31293235 0.24189402 1.0 Ti Ti6 1 0.50000000 0.00000000 0.50000000 1.0 Ti Ti7 1 0.50000000 0.50000000 0.00000000 1.0 Ti Ti8 1 0.00000000 0.50000000 0.00000000 1.0 Ti Ti9 1 0.00000000 0.50000000 0.50000000 1.0 Ti Ti10 1 0.50000000 0.00000000 0.00000000 1.0 Ti Ti11 1 0.50000000 0.50000000 0.50000000 1.0 Ag Ag12 1 0.00000000 0.00000000 0.50000000 1.0 Sn Sn13 1 0.19880326 0.39760652 0.74466030 1.0 Sn Sn14 1 0.80119674 0.19880326 0.25533970 1.0 Sn Sn15 1 0.39760652 0.19880326 0.25533970 1.0 Sn Sn16 1 0.60239348 0.80119674 0.74466030 1.0 Sn Sn17 1 0.19880326 0.80119674 0.74466030 1.0 Sn Sn18 1 0.80119674 0.60239348 0.25533970 1.0 Sn Sn19 1 0.66666700 0.33333300 0.75326112 1.0 Sn Sn20 1 0.33333300 0.66666700 0.24673888 1.0 Sn Sn21 1 0.00000000 0.00000000 0.00000000 1.0