# generated using pymatgen data_Hf18Re8NiAs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.53495679 _cell_length_b 8.53495606 _cell_length_c 8.57880026 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999901 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf18Re8NiAs _chemical_formula_sum 'Hf18 Re8 Ni1 As1' _cell_volume 541.20251800 _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 0.19233921 0.80766079 0.45186038 1.0 Hf Hf1 1 0.19233921 0.38467642 0.45186038 1.0 Hf Hf2 1 0.61532358 0.80766079 0.45186038 1.0 Hf Hf3 1 0.80154886 0.19845114 0.55676034 1.0 Hf Hf4 1 0.80154886 0.60309872 0.55676034 1.0 Hf Hf5 1 0.39690128 0.19845114 0.55676034 1.0 Hf Hf6 1 0.80154886 0.19845114 0.94323966 1.0 Hf Hf7 1 0.80154886 0.60309872 0.94323966 1.0 Hf Hf8 1 0.39690128 0.19845114 0.94323966 1.0 Hf Hf9 1 0.19233921 0.80766079 0.04813962 1.0 Hf Hf10 1 0.19233921 0.38467642 0.04813962 1.0 Hf Hf11 1 0.61532358 0.80766079 0.04813962 1.0 Hf Hf12 1 0.54265125 0.45734875 0.25000000 1.0 Hf Hf13 1 0.54265125 0.08530349 0.25000000 1.0 Hf Hf14 1 0.91469651 0.45734875 0.25000000 1.0 Hf Hf15 1 0.45882234 0.54117766 0.75000000 1.0 Hf Hf16 1 0.45882234 0.91764568 0.75000000 1.0 Hf Hf17 1 0.08235432 0.54117766 0.75000000 1.0 Re Re18 1 0.89002416 0.10997584 0.25000000 1.0 Re Re19 1 0.89002416 0.78004632 0.25000000 1.0 Re Re20 1 0.21995368 0.10997584 0.25000000 1.0 Re Re21 1 0.11028835 0.88971165 0.75000000 1.0 Re Re22 1 0.11028835 0.22057670 0.75000000 1.0 Re Re23 1 0.77942330 0.88971165 0.75000000 1.0 Re Re24 1 0.00000000 0.00000000 0.50081154 1.0 Re Re25 1 0.00000000 0.00000000 0.99918846 1.0 Ni Ni26 1 0.66666700 0.33333300 0.75000000 1.0 As As27 1 0.33333300 0.66666700 0.25000000 1.0