# generated using pymatgen data_Zr18FeCoRe8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.63700711 _cell_length_b 8.63700626 _cell_length_c 8.56917200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999566 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr18FeCoRe8 _chemical_formula_sum 'Zr18 Fe1 Co1 Re8' _cell_volume 553.59992443 _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 0.19823732 0.80176268 0.44174132 1.0 Zr Zr1 1 0.19823732 0.39647764 0.44174132 1.0 Zr Zr2 1 0.60352236 0.80176268 0.44174132 1.0 Zr Zr3 1 0.80160467 0.19839533 0.55920931 1.0 Zr Zr4 1 0.80160467 0.60320634 0.55920931 1.0 Zr Zr5 1 0.39679366 0.19839533 0.55920931 1.0 Zr Zr6 1 0.80160467 0.19839533 0.94079069 1.0 Zr Zr7 1 0.80160467 0.60320634 0.94079069 1.0 Zr Zr8 1 0.39679366 0.19839533 0.94079069 1.0 Zr Zr9 1 0.19823732 0.80176268 0.05825868 1.0 Zr Zr10 1 0.19823732 0.39647764 0.05825868 1.0 Zr Zr11 1 0.60352236 0.80176268 0.05825868 1.0 Zr Zr12 1 0.54214552 0.45785448 0.25000000 1.0 Zr Zr13 1 0.54214552 0.08429104 0.25000000 1.0 Zr Zr14 1 0.91570896 0.45785448 0.25000000 1.0 Zr Zr15 1 0.45796424 0.54203576 0.75000000 1.0 Zr Zr16 1 0.45796424 0.91592849 0.75000000 1.0 Zr Zr17 1 0.08407151 0.54203576 0.75000000 1.0 Fe Fe18 1 0.33333300 0.66666700 0.25000000 1.0 Co Co19 1 0.66666700 0.33333300 0.75000000 1.0 Re Re20 1 0.89309439 0.10690561 0.25000000 1.0 Re Re21 1 0.89309439 0.78619078 0.25000000 1.0 Re Re22 1 0.21380922 0.10690561 0.25000000 1.0 Re Re23 1 0.10768515 0.89231485 0.75000000 1.0 Re Re24 1 0.10768515 0.21536930 0.75000000 1.0 Re Re25 1 0.78463070 0.89231485 0.75000000 1.0 Re Re26 1 0.00000000 0.00000000 0.50048915 1.0 Re Re27 1 0.00000000 0.00000000 0.99951085 1.0