# generated using pymatgen data_HfNb4Si3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.63122463 _cell_length_b 7.67736966 _cell_length_c 7.67736901 _cell_angle_alpha 128.85700077 _cell_angle_beta 128.72190131 _cell_angle_gamma 75.48304172 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfNb4Si3 _chemical_formula_sum 'Hf2 Nb8 Si6' _cell_volume 265.72820354 _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 0.01114231 0.18441032 0.49999594 1.0 Hf Hf1 1 0.51114231 0.01114537 0.82673099 1.0 Nb Nb2 1 0.18392161 0.68457933 0.16165206 1.0 Nb Nb3 1 0.48303787 0.98204441 0.17136353 1.0 Nb Nb4 1 0.68392161 0.52226855 0.49934228 1.0 Nb Nb5 1 0.98303787 0.81167434 0.50099346 1.0 Nb Nb6 1 0.31687110 0.48019258 0.49965534 1.0 Nb Nb7 1 0.81687110 0.31721576 0.83667853 1.0 Nb Nb8 1 0.50372693 0.50402967 0.00171141 1.0 Nb Nb9 1 0.00372693 0.00201552 0.99969726 1.0 Si Si10 1 0.12995124 0.62960946 0.75643332 1.0 Si Si11 1 0.62995124 0.87351792 0.50034178 1.0 Si Si12 1 0.37149560 0.12990708 0.50064704 1.0 Si Si13 1 0.87149560 0.37084855 0.24158852 1.0 Si Si14 1 0.74985433 0.74471595 0.99803016 1.0 Si Si15 1 0.24985433 0.25182417 0.00513838 1.0