# generated using pymatgen data_Hf9NbFeRe3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.40427348 _cell_length_b 8.61656106 _cell_length_c 8.61656079 _cell_angle_alpha 119.99979439 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9NbFeRe3 _chemical_formula_sum 'Hf18 Nb2 Fe2 Re6' _cell_volume 540.38045677 _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 0.56071669 0.79779540 0.59559464 1.0 Hf Hf1 1 0.56072292 0.79779035 0.20220965 1.0 Hf Hf2 1 0.56071669 0.40440536 0.20220460 1.0 Hf Hf3 1 0.43928331 0.20220460 0.40440536 1.0 Hf Hf4 1 0.43927708 0.20220965 0.79779035 1.0 Hf Hf5 1 0.43928331 0.59559464 0.79779540 1.0 Hf Hf6 1 0.06071669 0.20220460 0.40440536 1.0 Hf Hf7 1 0.06072292 0.20220965 0.79779035 1.0 Hf Hf8 1 0.06071669 0.59559464 0.79779540 1.0 Hf Hf9 1 0.93928331 0.79779540 0.59559464 1.0 Hf Hf10 1 0.93927708 0.79779035 0.20220965 1.0 Hf Hf11 1 0.93928331 0.40440536 0.20220460 1.0 Hf Hf12 1 0.75000000 0.45865146 0.91732031 1.0 Hf Hf13 1 0.75000000 0.45865527 0.54134473 1.0 Hf Hf14 1 0.75000000 0.08267969 0.54134754 1.0 Hf Hf15 1 0.25000000 0.54134754 0.08267969 1.0 Hf Hf16 1 0.25000000 0.54134473 0.45865527 1.0 Hf Hf17 1 0.25000000 0.91732031 0.45865146 1.0 Nb Nb18 1 0.50000000 0.00000000 0.00000000 1.0 Nb Nb19 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe20 1 0.75000000 0.66664167 0.33335833 1.0 Fe Fe21 1 0.25000000 0.33335833 0.66664167 1.0 Re Re22 1 0.75000000 0.11426612 0.22855316 1.0 Re Re23 1 0.75000000 0.11427248 0.88572752 1.0 Re Re24 1 0.75000000 0.77144684 0.88573388 1.0 Re Re25 1 0.25000000 0.88573388 0.77144684 1.0 Re Re26 1 0.25000000 0.88572752 0.11427248 1.0 Re Re27 1 0.25000000 0.22855316 0.11426612 1.0