# generated using pymatgen data_Fe5C2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.22366451 _cell_length_b 6.22366451 _cell_length_c 4.98962659 _cell_angle_alpha 82.94196439 _cell_angle_beta 82.94196439 _cell_angle_gamma 42.45986446 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe5C2 _chemical_formula_sum 'Fe10 C4' _cell_volume 129.33171477 _cell_formula_units_Z 2 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 Fe Fe0 1 0.18176700 0.01502200 0.58300600 1.0 Fe Fe1 1 0.98497800 0.81823300 0.91699400 1.0 Fe Fe2 1 0.20379700 0.36757700 0.31061200 1.0 Fe Fe3 1 0.63242300 0.79620300 0.18938800 1.0 Fe Fe4 1 0.79620300 0.63242300 0.68938800 1.0 Fe Fe5 1 0.36757700 0.20379700 0.81061200 1.0 Fe Fe6 1 0.01502200 0.18176700 0.08300600 1.0 Fe Fe7 1 0.81823300 0.98497800 0.41699400 1.0 Fe Fe8 1 0.56722500 0.43277500 0.75000000 1.0 Fe Fe9 1 0.43277500 0.56722500 0.25000000 1.0 C C10 1 0.20141000 0.57247500 0.57871100 1.0 C C11 1 0.42752500 0.79859000 0.92128900 1.0 C C12 1 0.79859000 0.42752500 0.42128900 1.0 C C13 1 0.57247500 0.20141000 0.07871100 1.0