“…The following Gaussian basis sets were used: for the manganese atom a (15, 11,6) set contracted to [ 9,6,3 ] [3S], for the first row atoms a (10,6) set contracted to [ 4,2 ] [38], for hydrogen either a (6,l) set contracted to [ 3,l ] [39] (for the atom directly linked to the metal center), or a (4) set contracted [2] [38] for the other hydrogen atoms.…”