# generated using pymatgen data_TaTi3Nb3As4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.52956880 _cell_length_b 7.79139598 _cell_length_c 14.09592415 _cell_angle_alpha 103.90007036 _cell_angle_beta 90.00000001 _cell_angle_gamma 103.09135371 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTi3Nb3As4 _chemical_formula_sum 'Ta2 Ti6 Nb6 As8' _cell_volume 365.90289938 _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 0.00000000 0.00000000 0.00000000 1.0 Ta Ta1 1 0.50000000 0.00000000 0.50000000 1.0 Ti Ti2 1 0.43187331 0.86374763 0.82800449 1.0 Ti Ti3 1 0.56812669 0.13625237 0.17199551 1.0 Ti Ti4 1 0.19810495 0.39621089 0.30854605 1.0 Ti Ti5 1 0.80189505 0.60378911 0.69145395 1.0 Ti Ti6 1 0.21131071 0.42262241 0.79764690 1.0 Ti Ti7 1 0.78868929 0.57737759 0.20235310 1.0 Nb Nb8 1 0.33623225 0.67246451 0.02919919 1.0 Nb Nb9 1 0.66376775 0.32753549 0.97080081 1.0 Nb Nb10 1 0.00080336 0.00160573 0.66041044 1.0 Nb Nb11 1 0.99919664 0.99839427 0.33958956 1.0 Nb Nb12 1 0.17534058 0.35068116 0.54492538 1.0 Nb Nb13 1 0.82465942 0.64931884 0.45507462 1.0 As As14 1 0.17470970 0.34941840 0.11501181 1.0 As As15 1 0.82529030 0.65058160 0.88498819 1.0 As As16 1 0.36851214 0.73702527 0.60528988 1.0 As As17 1 0.63148786 0.26297473 0.39471012 1.0 As As18 1 0.36873286 0.73746573 0.33216652 1.0 As As19 1 0.63126714 0.26253427 0.66783348 1.0 As As20 1 0.06431753 0.12863706 0.84707424 1.0 As As21 1 0.93568247 0.87136294 0.15292576 1.0