# generated using pymatgen data_Fe7C3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.82578370 _cell_length_b 6.82578370 _cell_length_c 4.49481600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999711 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe7C3 _chemical_formula_sum 'Fe14 C6' _cell_volume 181.36254713 _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 0.09130400 0.54565200 0.31582000 1.0 Fe Fe1 1 0.54565200 0.45434800 0.81582000 1.0 Fe Fe2 1 0.12240600 0.87759400 0.98968400 1.0 Fe Fe3 1 0.24481100 0.12240600 0.48968400 1.0 Fe Fe4 1 0.87759400 0.75518900 0.48968400 1.0 Fe Fe5 1 0.12240600 0.24481100 0.98968400 1.0 Fe Fe6 1 0.75518900 0.87759400 0.98968400 1.0 Fe Fe7 1 0.87759400 0.12240600 0.48968400 1.0 Fe Fe8 1 0.45434800 0.90869600 0.31582000 1.0 Fe Fe9 1 0.54565200 0.09130400 0.81582000 1.0 Fe Fe10 1 0.90869600 0.45434800 0.81582000 1.0 Fe Fe11 1 0.45434800 0.54565200 0.31582000 1.0 Fe Fe12 1 0.66666700 0.33333300 0.30788900 1.0 Fe Fe13 1 0.33333300 0.66666700 0.80788900 1.0 C C14 1 0.81344100 0.18655900 0.09586700 1.0 C C15 1 0.62688200 0.81344100 0.59586700 1.0 C C16 1 0.18655900 0.37311800 0.59586700 1.0 C C17 1 0.81344100 0.62688200 0.09586700 1.0 C C18 1 0.37311800 0.18655900 0.09586700 1.0 C C19 1 0.18655900 0.81344100 0.59586700 1.0