# generated using pymatgen data_TaNb23GaAs11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.51733509 _cell_length_b 12.03412335 _cell_length_c 14.83276110 _cell_angle_alpha 89.75351614 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaNb23GaAs11 _chemical_formula_sum 'Ta1 Nb23 Ga1 As11' _cell_volume 627.83595953 _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 Ta Ta0 1 0.50000000 0.02653539 0.39032620 1.0 Nb Nb1 1 0.00000000 0.18652922 0.29598311 1.0 Nb Nb2 1 0.00000000 0.52657852 0.10960657 1.0 Nb Nb3 1 0.50000000 0.91042318 0.07883281 1.0 Nb Nb4 1 0.00000000 0.88639139 0.92728635 1.0 Nb Nb5 1 0.00000000 0.86060449 0.47704132 1.0 Nb Nb6 1 0.50000000 0.68952520 0.20476160 1.0 Nb Nb7 1 0.50000000 0.38665277 0.57258660 1.0 Nb Nb8 1 0.00000000 0.58658218 0.57620399 1.0 Nb Nb9 1 0.50000000 0.61182435 0.42669307 1.0 Nb Nb10 1 0.00000000 0.08753215 0.75903100 1.0 Nb Nb11 1 0.50000000 0.64226069 0.97715592 1.0 Nb Nb12 1 0.00000000 0.14375220 0.52314867 1.0 Nb Nb13 1 0.00000000 0.40926592 0.42049000 1.0 Nb Nb14 1 0.50000000 0.41457172 0.25644264 1.0 Nb Nb15 1 0.50000000 0.58673584 0.73995976 1.0 Nb Nb16 1 0.50000000 0.97365066 0.60993238 1.0 Nb Nb17 1 0.50000000 0.35694444 0.02232773 1.0 Nb Nb18 1 0.00000000 0.11258231 0.07380080 1.0 Nb Nb19 1 0.50000000 0.08850798 0.92264587 1.0 Nb Nb20 1 0.00000000 0.47326096 0.89032936 1.0 Nb Nb21 1 0.00000000 0.81546048 0.70519615 1.0 Nb Nb22 1 0.50000000 0.31215532 0.79532885 1.0 Nb Nb23 1 0.00000000 0.91466971 0.24381877 1.0 Ga Ga24 1 0.50000000 0.74710557 0.58327984 1.0 As As25 1 0.00000000 0.42749180 0.70358423 1.0 As As26 1 0.00000000 0.24723494 0.91672438 1.0 As As27 1 0.00000000 0.30980282 0.15083649 1.0 As As28 1 0.50000000 0.25158511 0.41656940 1.0 As As29 1 0.00000000 0.57284495 0.29653073 1.0 As As30 1 0.50000000 0.19025242 0.65146928 1.0 As As31 1 0.00000000 0.75170205 0.08278994 1.0 As As32 1 0.50000000 0.80950122 0.35114680 1.0 As As33 1 0.00000000 0.68955255 0.84783711 1.0 As As34 1 0.50000000 0.07229815 0.20379509 1.0 As As35 1 0.50000000 0.92763131 0.79650423 1.0