4 C 0.235203215896056 0.019434120056605 0.091769158335522 C 1.371929185006107 1.277465597199166 0.295534410002176 Fe 1.341253012034589 0.006014570924093 1.207634716184697 Fe -0.050550513464833 1.289017536931626 1.480068955497393