# generated using pymatgen data_Ti5GaSn3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.22151489 _cell_length_b 8.22151453 _cell_length_c 5.55765871 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000146 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti5GaSn3 _chemical_formula_sum 'Ti10 Ga2 Sn6' _cell_volume 325.33154483 _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 0.33333300 0.66666700 0.00000000 1.0 Ti Ti1 1 0.66666700 0.33333300 0.50000000 1.0 Ti Ti2 1 0.66666700 0.33333300 0.00000000 1.0 Ti Ti3 1 0.33333300 0.66666700 0.50000000 1.0 Ti Ti4 1 0.26639718 0.00000000 0.25000000 1.0 Ti Ti5 1 0.26639718 0.26639718 0.75000000 1.0 Ti Ti6 1 0.00000000 0.73360282 0.75000000 1.0 Ti Ti7 1 1.00000000 0.26639718 0.25000000 1.0 Ti Ti8 1 0.73360282 0.73360282 0.25000000 1.0 Ti Ti9 1 0.73360282 0.00000000 0.75000000 1.0 Ga Ga10 1 0.00000000 0.00000000 0.00000000 1.0 Ga Ga11 1 0.00000000 0.00000000 0.50000000 1.0 Sn Sn12 1 0.61137135 0.00000000 0.25000000 1.0 Sn Sn13 1 0.61137135 0.61137135 0.75000000 1.0 Sn Sn14 1 0.00000000 0.38862865 0.75000000 1.0 Sn Sn15 1 1.00000000 0.61137135 0.25000000 1.0 Sn Sn16 1 0.38862865 0.38862865 0.25000000 1.0 Sn Sn17 1 0.38862865 0.00000000 0.75000000 1.0