# generated using pymatgen data_Hf16Nb3Ni4Hg _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.76904761 _cell_length_b 8.76904697 _cell_length_c 8.76904854 _cell_angle_alpha 59.61744913 _cell_angle_beta 59.61745026 _cell_angle_gamma 59.61745471 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf16Nb3Ni4Hg _chemical_formula_sum 'Hf16 Nb3 Ni4 Hg1' _cell_volume 472.66130968 _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 Hf Hf0 1 0.70407891 0.09738760 0.09738760 1.0 Hf Hf1 1 0.09738760 0.70407891 0.09738760 1.0 Hf Hf2 1 0.09738760 0.09738760 0.70407891 1.0 Hf Hf3 1 0.10154310 0.10154310 0.10154310 1.0 Hf Hf4 1 0.31574249 0.31574249 0.69289498 1.0 Hf Hf5 1 0.68624645 0.68624645 0.31509296 1.0 Hf Hf6 1 0.31574249 0.69289498 0.31574249 1.0 Hf Hf7 1 0.68624645 0.31509296 0.68624645 1.0 Hf Hf8 1 0.69289498 0.31574249 0.31574249 1.0 Hf Hf9 1 0.31509296 0.68624645 0.68624645 1.0 Hf Hf10 1 0.95010148 0.95010148 0.54799503 1.0 Hf Hf11 1 0.55556657 0.55556657 0.94083567 1.0 Hf Hf12 1 0.95010148 0.54799503 0.95010148 1.0 Hf Hf13 1 0.55556657 0.94083567 0.55556657 1.0 Hf Hf14 1 0.54799503 0.95010148 0.95010148 1.0 Hf Hf15 1 0.94083567 0.55556657 0.55556657 1.0 Nb Nb16 1 0.99487605 0.33187129 0.33187129 1.0 Nb Nb17 1 0.33187129 0.99487605 0.33187129 1.0 Nb Nb18 1 0.33187129 0.33187129 0.99487605 1.0 Ni Ni19 1 0.32547551 0.88963835 0.88963835 1.0 Ni Ni20 1 0.88963835 0.32547551 0.88963835 1.0 Ni Ni21 1 0.88963835 0.88963835 0.32547551 1.0 Ni Ni22 1 0.89108612 0.89108612 0.89108612 1.0 Hg Hg23 1 0.33300921 0.33300921 0.33300921 1.0