# generated using pymatgen data_Hf18CoRe8Se _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.54183177 _cell_length_b 8.54183109 _cell_length_c 8.56388628 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999506 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf18CoRe8Se _chemical_formula_sum 'Hf18 Co1 Re8 Se1' _cell_volume 541.13240058 _cell_formula_units_Z 1 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 0.19125265 0.80874735 0.45163754 1.0 Hf Hf1 1 0.19125265 0.38250630 0.45163754 1.0 Hf Hf2 1 0.61749370 0.80874735 0.45163754 1.0 Hf Hf3 1 0.80050828 0.19949172 0.55909192 1.0 Hf Hf4 1 0.80050828 0.60101557 0.55909192 1.0 Hf Hf5 1 0.39898443 0.19949172 0.55909192 1.0 Hf Hf6 1 0.80050828 0.19949172 0.94090808 1.0 Hf Hf7 1 0.80050828 0.60101557 0.94090808 1.0 Hf Hf8 1 0.39898443 0.19949172 0.94090808 1.0 Hf Hf9 1 0.19125265 0.80874735 0.04836246 1.0 Hf Hf10 1 0.19125265 0.38250630 0.04836246 1.0 Hf Hf11 1 0.61749370 0.80874735 0.04836246 1.0 Hf Hf12 1 0.54519625 0.45480375 0.25000000 1.0 Hf Hf13 1 0.54519625 0.09039250 0.25000000 1.0 Hf Hf14 1 0.90960750 0.45480375 0.25000000 1.0 Hf Hf15 1 0.45871492 0.54128508 0.75000000 1.0 Hf Hf16 1 0.45871492 0.91742883 0.75000000 1.0 Hf Hf17 1 0.08257117 0.54128508 0.75000000 1.0 Co Co18 1 0.66666700 0.33333300 0.75000000 1.0 Re Re19 1 0.88976554 0.11023446 0.25000000 1.0 Re Re20 1 0.88976554 0.77953209 0.25000000 1.0 Re Re21 1 0.22046791 0.11023446 0.25000000 1.0 Re Re22 1 0.11038880 0.88961120 0.75000000 1.0 Re Re23 1 0.11038880 0.22077659 0.75000000 1.0 Re Re24 1 0.77922341 0.88961120 0.75000000 1.0 Re Re25 1 0.00000000 0.00000000 0.50107287 1.0 Re Re26 1 0.00000000 0.00000000 0.99892713 1.0 Se Se27 1 0.33333300 0.66666700 0.25000000 1.0