-5217.44836588	-5217.22863811	-5217.22634201	-5217.55553826	-5217.55280082
The required energies are:

        cation - neutral = 5.98 
	cation_v - neutral = 6.04 
	
	neutral - anion = 2.92 
	neutral - anion_v = 2.84 

	gap = 3.20