# generated using pymatgen data_Hf9NbCoRe3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.62129117 _cell_length_b 8.62128953 _cell_length_c 8.39709355 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999871 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9NbCoRe3 _chemical_formula_sum 'Hf18 Nb2 Co2 Re6' _cell_volume 540.51054610 _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 0.20178780 0.79821220 0.44016217 1.0 Hf Hf1 1 0.20178780 0.40357661 0.44016217 1.0 Hf Hf2 1 0.59642339 0.79821220 0.44016217 1.0 Hf Hf3 1 0.79821220 0.20178780 0.55983783 1.0 Hf Hf4 1 0.79821220 0.59642339 0.55983783 1.0 Hf Hf5 1 0.40357661 0.20178780 0.55983783 1.0 Hf Hf6 1 0.79821220 0.20178780 0.94016217 1.0 Hf Hf7 1 0.79821220 0.59642339 0.94016217 1.0 Hf Hf8 1 0.40357661 0.20178780 0.94016217 1.0 Hf Hf9 1 0.20178780 0.79821220 0.05983783 1.0 Hf Hf10 1 0.20178780 0.40357661 0.05983783 1.0 Hf Hf11 1 0.59642339 0.79821220 0.05983783 1.0 Hf Hf12 1 0.54187565 0.45812435 0.25000000 1.0 Hf Hf13 1 0.54187565 0.08375231 0.25000000 1.0 Hf Hf14 1 0.91624769 0.45812435 0.25000000 1.0 Hf Hf15 1 0.45812435 0.54187565 0.75000000 1.0 Hf Hf16 1 0.45812435 0.91624769 0.75000000 1.0 Hf Hf17 1 0.08375231 0.54187565 0.75000000 1.0 Nb Nb18 1 0.00000000 0.00000000 0.50000000 1.0 Nb Nb19 1 0.00000000 0.00000000 0.00000000 1.0 Co Co20 1 0.33333300 0.66666700 0.25000000 1.0 Co Co21 1 0.66666700 0.33333300 0.75000000 1.0 Re Re22 1 0.88543432 0.11456568 0.25000000 1.0 Re Re23 1 0.88543432 0.77086863 0.25000000 1.0 Re Re24 1 0.22913137 0.11456568 0.25000000 1.0 Re Re25 1 0.11456568 0.88543432 0.75000000 1.0 Re Re26 1 0.11456568 0.22913137 0.75000000 1.0 Re Re27 1 0.77086863 0.88543432 0.75000000 1.0