# generated using pymatgen data_Hf9Nb4Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.85489310 _cell_length_b 8.85489163 _cell_length_c 8.43480828 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000173 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9Nb4Ni _chemical_formula_sum 'Hf18 Nb8 Ni2' _cell_volume 572.75964736 _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 0.20336589 0.79663411 0.44001666 1.0 Hf Hf1 1 0.20336589 0.40673177 0.44001666 1.0 Hf Hf2 1 0.59326823 0.79663411 0.44001666 1.0 Hf Hf3 1 0.79663411 0.20336589 0.55998334 1.0 Hf Hf4 1 0.79663411 0.59326823 0.55998334 1.0 Hf Hf5 1 0.40673177 0.20336589 0.55998334 1.0 Hf Hf6 1 0.79663411 0.20336589 0.94001666 1.0 Hf Hf7 1 0.79663411 0.59326823 0.94001666 1.0 Hf Hf8 1 0.40673177 0.20336589 0.94001666 1.0 Hf Hf9 1 0.20336589 0.79663411 0.05998334 1.0 Hf Hf10 1 0.20336589 0.40673177 0.05998334 1.0 Hf Hf11 1 0.59326823 0.79663411 0.05998334 1.0 Hf Hf12 1 0.54134699 0.45865301 0.25000000 1.0 Hf Hf13 1 0.54134699 0.08269299 0.25000000 1.0 Hf Hf14 1 0.91730701 0.45865301 0.25000000 1.0 Hf Hf15 1 0.45865301 0.54134699 0.75000000 1.0 Hf Hf16 1 0.45865301 0.91730701 0.75000000 1.0 Hf Hf17 1 0.08269299 0.54134699 0.75000000 1.0 Nb Nb18 1 0.88334134 0.11665866 0.25000000 1.0 Nb Nb19 1 0.88334134 0.76668368 0.25000000 1.0 Nb Nb20 1 0.23331632 0.11665866 0.25000000 1.0 Nb Nb21 1 0.11665866 0.88334134 0.75000000 1.0 Nb Nb22 1 0.11665866 0.23331632 0.75000000 1.0 Nb Nb23 1 0.76668368 0.88334134 0.75000000 1.0 Nb Nb24 1 0.00000000 0.00000000 0.50000000 1.0 Nb Nb25 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni26 1 0.33333300 0.66666700 0.25000000 1.0 Ni Ni27 1 0.66666700 0.33333300 0.75000000 1.0