# generated using pymatgen data_Fe2W2C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.87592362 _cell_length_b 7.87592362 _cell_length_c 7.87592362 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe2W2C _chemical_formula_sum 'Fe12 W12 C6' _cell_volume 345.45341432 _cell_formula_units_Z 6 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 0.82589300 0.82589300 0.82589300 1.0 Fe Fe1 1 0.82589300 0.52232200 0.82589300 1.0 Fe Fe2 1 0.82589300 0.82589300 0.52232200 1.0 Fe Fe3 1 0.52232200 0.82589300 0.82589300 1.0 Fe Fe4 1 0.42410700 0.42410700 0.42410700 1.0 Fe Fe5 1 0.42410700 0.72767800 0.42410700 1.0 Fe Fe6 1 0.42410700 0.42410700 0.72767800 1.0 Fe Fe7 1 0.72767800 0.42410700 0.42410700 1.0 Fe Fe8 1 0.62500000 0.62500000 0.62500000 1.0 Fe Fe9 1 0.62500000 0.12500000 0.62500000 1.0 Fe Fe10 1 0.62500000 0.62500000 0.12500000 1.0 Fe Fe11 1 0.12500000 0.62500000 0.62500000 1.0 W W12 1 0.19980700 0.80019300 0.19980700 1.0 W W13 1 0.19980700 0.19980700 0.80019300 1.0 W W14 1 0.80019300 0.19980700 0.19980700 1.0 W W15 1 0.19980700 0.80019300 0.80019300 1.0 W W16 1 0.80019300 0.80019300 0.19980700 1.0 W W17 1 0.80019300 0.19980700 0.80019300 1.0 W W18 1 0.05019300 0.44980700 0.05019300 1.0 W W19 1 0.05019300 0.05019300 0.44980700 1.0 W W20 1 0.44980700 0.05019300 0.05019300 1.0 W W21 1 0.05019300 0.44980700 0.44980700 1.0 W W22 1 0.44980700 0.44980700 0.05019300 1.0 W W23 1 0.44980700 0.05019300 0.44980700 1.0 C C24 1 0.12500000 0.12500000 0.12500000 1.0 C C25 1 0.12500000 0.62500000 0.12500000 1.0 C C26 1 0.12500000 0.12500000 0.62500000 1.0 C C27 1 0.62500000 0.12500000 0.12500000 1.0 C C28 1 0.00000000 0.00000000 0.00000000 1.0 C C29 1 0.25000000 0.25000000 0.25000000 1.0