# generated using pymatgen data_Hf9Nb3ReP _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.66575116 _cell_length_b 8.66575125 _cell_length_c 8.74550106 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999967 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9Nb3ReP _chemical_formula_sum 'Hf18 Nb6 Re2 P2' _cell_volume 568.75831945 _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 0.19854050 0.80145950 0.45222137 1.0 Hf Hf1 1 0.19854050 0.39708000 0.45222137 1.0 Hf Hf2 1 0.60292000 0.80145950 0.45222137 1.0 Hf Hf3 1 0.80145950 0.19854050 0.54777863 1.0 Hf Hf4 1 0.80145950 0.60292000 0.54777863 1.0 Hf Hf5 1 0.39708000 0.19854050 0.54777863 1.0 Hf Hf6 1 0.80145950 0.19854050 0.95222137 1.0 Hf Hf7 1 0.80145950 0.60292000 0.95222137 1.0 Hf Hf8 1 0.39708000 0.19854050 0.95222137 1.0 Hf Hf9 1 0.19854050 0.80145950 0.04777863 1.0 Hf Hf10 1 0.19854050 0.39708000 0.04777863 1.0 Hf Hf11 1 0.60292000 0.80145950 0.04777863 1.0 Hf Hf12 1 0.53840219 0.46159781 0.25000000 1.0 Hf Hf13 1 0.53840219 0.07680438 0.25000000 1.0 Hf Hf14 1 0.92319562 0.46159781 0.25000000 1.0 Hf Hf15 1 0.46159781 0.53840219 0.75000000 1.0 Hf Hf16 1 0.46159781 0.92319562 0.75000000 1.0 Hf Hf17 1 0.07680438 0.53840219 0.75000000 1.0 Nb Nb18 1 0.88886242 0.11113758 0.25000000 1.0 Nb Nb19 1 0.88886242 0.77772384 0.25000000 1.0 Nb Nb20 1 0.22227616 0.11113758 0.25000000 1.0 Nb Nb21 1 0.11113758 0.88886242 0.75000000 1.0 Nb Nb22 1 0.11113758 0.22227616 0.75000000 1.0 Nb Nb23 1 0.77772384 0.88886242 0.75000000 1.0 Re Re24 1 0.00000000 0.00000000 0.50000000 1.0 Re Re25 1 0.00000000 0.00000000 0.00000000 1.0 P P26 1 0.33333300 0.66666700 0.25000000 1.0 P P27 1 0.66666700 0.33333300 0.75000000 1.0