# generated using pymatgen data_Hf9AlRe3Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.58981645 _cell_length_b 8.58981520 _cell_length_c 8.31418683 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999722 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9AlRe3Ni _chemical_formula_sum 'Hf18 Al2 Re6 Ni2' _cell_volume 531.27346827 _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 0.19685020 0.80314980 0.44004769 1.0 Hf Hf1 1 0.19685020 0.39370139 0.44004769 1.0 Hf Hf2 1 0.60629861 0.80314980 0.44004769 1.0 Hf Hf3 1 0.80314980 0.19685020 0.55995231 1.0 Hf Hf4 1 0.80314980 0.60629861 0.55995231 1.0 Hf Hf5 1 0.39370139 0.19685020 0.55995231 1.0 Hf Hf6 1 0.80314980 0.19685020 0.94004769 1.0 Hf Hf7 1 0.80314980 0.60629861 0.94004769 1.0 Hf Hf8 1 0.39370139 0.19685020 0.94004769 1.0 Hf Hf9 1 0.19685020 0.80314980 0.05995231 1.0 Hf Hf10 1 0.19685020 0.39370139 0.05995231 1.0 Hf Hf11 1 0.60629861 0.80314980 0.05995231 1.0 Hf Hf12 1 0.54317585 0.45682415 0.25000000 1.0 Hf Hf13 1 0.54317585 0.08635270 0.25000000 1.0 Hf Hf14 1 0.91364730 0.45682415 0.25000000 1.0 Hf Hf15 1 0.45682415 0.54317585 0.75000000 1.0 Hf Hf16 1 0.45682415 0.91364730 0.75000000 1.0 Hf Hf17 1 0.08635270 0.54317585 0.75000000 1.0 Al Al18 1 0.00000000 0.00000000 0.50000000 1.0 Al Al19 1 0.00000000 0.00000000 0.00000000 1.0 Re Re20 1 0.88601935 0.11398065 0.25000000 1.0 Re Re21 1 0.88601935 0.77203870 0.25000000 1.0 Re Re22 1 0.22796130 0.11398065 0.25000000 1.0 Re Re23 1 0.11398065 0.88601935 0.75000000 1.0 Re Re24 1 0.11398065 0.22796130 0.75000000 1.0 Re Re25 1 0.77203870 0.88601935 0.75000000 1.0 Ni Ni26 1 0.33333300 0.66666700 0.25000000 1.0 Ni Ni27 1 0.66666700 0.33333300 0.75000000 1.0