# generated using pymatgen data_Zr18FeCuRe8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.65174388 _cell_length_b 8.65174352 _cell_length_c 8.57214870 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999376 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr18FeCuRe8 _chemical_formula_sum 'Zr18 Fe1 Cu1 Re8' _cell_volume 555.68368517 _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 Zr Zr0 1 0.20062593 0.79937407 0.44058642 1.0 Zr Zr1 1 0.20062593 0.40125186 0.44058642 1.0 Zr Zr2 1 0.59874814 0.79937407 0.44058642 1.0 Zr Zr3 1 0.80562912 0.19437088 0.55460615 1.0 Zr Zr4 1 0.80562912 0.61125824 0.55460615 1.0 Zr Zr5 1 0.38874176 0.19437088 0.55460615 1.0 Zr Zr6 1 0.80562912 0.19437088 0.94539385 1.0 Zr Zr7 1 0.80562912 0.61125824 0.94539385 1.0 Zr Zr8 1 0.38874176 0.19437088 0.94539385 1.0 Zr Zr9 1 0.20062593 0.79937407 0.05941358 1.0 Zr Zr10 1 0.20062593 0.40125186 0.05941358 1.0 Zr Zr11 1 0.59874814 0.79937407 0.05941358 1.0 Zr Zr12 1 0.54147862 0.45852138 0.25000000 1.0 Zr Zr13 1 0.54147862 0.08295723 0.25000000 1.0 Zr Zr14 1 0.91704277 0.45852138 0.25000000 1.0 Zr Zr15 1 0.45776266 0.54223734 0.75000000 1.0 Zr Zr16 1 0.45776266 0.91552333 0.75000000 1.0 Zr Zr17 1 0.08447667 0.54223734 0.75000000 1.0 Fe Fe18 1 0.33333300 0.66666700 0.25000000 1.0 Cu Cu19 1 0.66666700 0.33333300 0.75000000 1.0 Re Re20 1 0.89213635 0.10786365 0.25000000 1.0 Re Re21 1 0.89213635 0.78427270 0.25000000 1.0 Re Re22 1 0.21572730 0.10786365 0.25000000 1.0 Re Re23 1 0.10872643 0.89127357 0.75000000 1.0 Re Re24 1 0.10872643 0.21745186 0.75000000 1.0 Re Re25 1 0.78254814 0.89127357 0.75000000 1.0 Re Re26 1 0.00000000 0.00000000 0.49951716 1.0 Re Re27 1 0.00000000 0.00000000 0.00048284 1.0