# generated using pymatgen data_TaTi4NbSn5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.31112278 _cell_length_b 9.36157759 _cell_length_c 5.67699381 _cell_angle_alpha 90.34796476 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.82187425 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTi4NbSn5 _chemical_formula_sum 'Ta2 Ti8 Nb2 Sn10' _cell_volume 429.30528204 _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 Ta Ta0 1 0.50000000 0.00000000 0.50000000 1.0 Ta Ta1 1 0.50000000 0.00000000 0.00000000 1.0 Ti Ti2 1 0.84363481 0.68727162 0.76287268 1.0 Ti Ti3 1 0.16155767 0.84766620 0.24383954 1.0 Ti Ti4 1 0.68610853 0.84766620 0.24383954 1.0 Ti Ti5 1 0.31389147 0.15233380 0.75616046 1.0 Ti Ti6 1 0.83844233 0.15233380 0.75616046 1.0 Ti Ti7 1 0.15636519 0.31272838 0.23712732 1.0 Ti Ti8 1 0.00000000 0.50000000 0.50000000 1.0 Ti Ti9 1 0.50000000 0.50000000 0.50000000 1.0 Nb Nb10 1 0.50000000 0.50000000 0.00000000 1.0 Nb Nb11 1 0.00000000 0.50000000 0.00000000 1.0 Sn Sn12 1 0.20247367 0.40494734 0.73743165 1.0 Sn Sn13 1 0.79806103 0.20726711 0.25581962 1.0 Sn Sn14 1 0.40920607 0.20726711 0.25581962 1.0 Sn Sn15 1 0.59079393 0.79273289 0.74418038 1.0 Sn Sn16 1 0.20193897 0.79273289 0.74418038 1.0 Sn Sn17 1 0.79752633 0.59505266 0.26256835 1.0 Sn Sn18 1 0.66777228 0.33554457 0.75648362 1.0 Sn Sn19 1 0.33222772 0.66445543 0.24351638 1.0 Sn Sn20 1 0.00000000 0.00000000 0.50000000 1.0 Sn Sn21 1 0.00000000 0.00000000 0.00000000 1.0