# generated using pymatgen data_Hf9Nb3TcAs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.71161878 _cell_length_b 8.71161899 _cell_length_c 8.77116934 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.02132850 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9Nb3TcAs _chemical_formula_sum 'Hf18 Nb6 Tc2 As2' _cell_volume 576.35821010 _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 Hf Hf0 1 0.80324164 0.60649539 0.54536226 1.0 Hf Hf1 1 0.80295322 0.19704678 0.54518628 1.0 Hf Hf2 1 0.39350461 0.19675836 0.54536226 1.0 Hf Hf3 1 0.19675836 0.39350461 0.45463774 1.0 Hf Hf4 1 0.19704678 0.80295322 0.45481372 1.0 Hf Hf5 1 0.60649539 0.80324164 0.45463774 1.0 Hf Hf6 1 0.19675836 0.39350461 0.04536226 1.0 Hf Hf7 1 0.19704678 0.80295322 0.04518628 1.0 Hf Hf8 1 0.60649539 0.80324164 0.04536226 1.0 Hf Hf9 1 0.80324164 0.60649539 0.95463774 1.0 Hf Hf10 1 0.80295322 0.19704678 0.95481372 1.0 Hf Hf11 1 0.39350461 0.19675836 0.95463774 1.0 Hf Hf12 1 0.46089481 0.92177775 0.75000000 1.0 Hf Hf13 1 0.46089125 0.53910875 0.75000000 1.0 Hf Hf14 1 0.07822225 0.53910519 0.75000000 1.0 Hf Hf15 1 0.53910519 0.07822225 0.25000000 1.0 Hf Hf16 1 0.53910875 0.46089125 0.25000000 1.0 Hf Hf17 1 0.92177775 0.46089481 0.25000000 1.0 Nb Nb18 1 0.11029744 0.22092826 0.75000000 1.0 Nb Nb19 1 0.11047505 0.88952495 0.75000000 1.0 Nb Nb20 1 0.77907174 0.88970256 0.75000000 1.0 Nb Nb21 1 0.88970256 0.77907174 0.25000000 1.0 Nb Nb22 1 0.88952495 0.11047505 0.25000000 1.0 Nb Nb23 1 0.22092826 0.11029744 0.25000000 1.0 Tc Tc24 1 0.00000000 0.00000000 0.50000000 1.0 Tc Tc25 1 0.00000000 0.00000000 0.00000000 1.0 As As26 1 0.66655507 0.33344493 0.75000000 1.0 As As27 1 0.33344493 0.66655507 0.25000000 1.0