# generated using pymatgen data_Ta16Nb8As7P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.38432775 _cell_length_b 10.35079801 _cell_length_c 5.12863518 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.85791103 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta16Nb8As7P _chemical_formula_sum 'Ta16 Nb8 As7 P1' _cell_volume 551.25519110 _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 0.90869027 0.59084970 0.50019396 1.0 Ta Ta1 1 0.90905309 0.40930937 0.00034836 1.0 Ta Ta2 1 0.59068859 0.09065253 0.50007431 1.0 Ta Ta3 1 0.79781013 0.29918904 0.50086293 1.0 Ta Ta4 1 0.09094691 0.40930937 0.49965164 1.0 Ta Ta5 1 0.09130973 0.59084970 0.99980604 1.0 Ta Ta6 1 0.20218987 0.29918904 0.99913707 1.0 Ta Ta7 1 0.30281349 0.79684139 0.99611789 1.0 Ta Ta8 1 0.29889962 0.20115895 0.50001787 1.0 Ta Ta9 1 0.70110038 0.20115895 0.99998213 1.0 Ta Ta10 1 0.58862109 0.90553565 0.99601831 1.0 Ta Ta11 1 0.69718651 0.79684139 0.50388211 1.0 Ta Ta12 1 0.20122729 0.70227401 0.49725337 1.0 Ta Ta13 1 0.40931141 0.09065253 0.99992569 1.0 Ta Ta14 1 0.41137891 0.90553565 0.50398169 1.0 Ta Ta15 1 0.79877271 0.70227401 0.00274663 1.0 Nb Nb16 1 0.50000000 0.65090484 0.25000000 1.0 Nb Nb17 1 0.85015546 0.99947197 0.74860634 1.0 Nb Nb18 1 0.64640249 0.50579205 0.74975409 1.0 Nb Nb19 1 0.00000000 0.85066433 0.25000000 1.0 Nb Nb20 1 0.35359751 0.50579205 0.75024591 1.0 Nb Nb21 1 0.00000000 0.14809719 0.25000000 1.0 Nb Nb22 1 0.50000000 0.35151995 0.25000000 1.0 Nb Nb23 1 0.14984454 0.99947197 0.75139366 1.0 As As24 1 0.00000000 0.79285974 0.75000000 1.0 As As25 1 0.50000000 0.29429671 0.75000000 1.0 As As26 1 0.20866519 0.99713886 0.25187963 1.0 As As27 1 0.79133481 0.99713886 0.24812037 1.0 As As28 1 0.00000000 0.20658581 0.75000000 1.0 As As29 1 0.70646025 0.50051819 0.24991754 1.0 As As30 1 0.29353975 0.50051819 0.25008246 1.0 P P31 1 0.50000000 0.70760603 0.75000000 1.0