# generated using pymatgen data_Zn13Fe _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.07502858 _cell_length_b 6.48548284 _cell_length_c 6.48547394 _cell_angle_alpha 70.37653804 _cell_angle_beta 80.93352305 _cell_angle_gamma 80.93362115 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zn13Fe _chemical_formula_sum 'Zn13 Fe1' _cell_volume 197.29212470 _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 Zn Zn0 1 0.99999988 0.00000111 0.99999873 1.0 Zn Zn1 1 0.93885510 0.38498265 0.38498028 1.0 Zn Zn2 1 0.06114466 0.61501739 0.61501943 1.0 Zn Zn3 1 0.37565224 0.77673138 0.77673557 1.0 Zn Zn4 1 0.62434802 0.22326648 0.22326582 1.0 Zn Zn5 1 0.31572207 0.62929591 0.21800543 1.0 Zn Zn6 1 0.68428436 0.78199321 0.37070396 1.0 Zn Zn7 1 0.68427896 0.37070355 0.78199512 1.0 Zn Zn8 1 0.31571557 0.21800671 0.62929578 1.0 Zn Zn9 1 0.80180102 0.64295075 0.00620238 1.0 Zn Zn10 1 0.19820052 0.99379621 0.35705094 1.0 Zn Zn11 1 0.19819995 0.35705015 0.99379777 1.0 Zn Zn12 1 0.80179851 0.00620363 0.64294788 1.0 Fe Fe13 1 0.50000013 -0.00000014 0.99999992 1.0