%oldchk=cluster_model_staffetta_prot_ener_opt_freq_reag_deprot.chk
%chk=cluster_model_staffetta_prot_ener_opt_freq_reag_deprot2.chk
%nproc=16
%mem=64GB
#p freq b3lyp/6-31g(d) nosymm int=superfinegrid scf opt=(modredundant,tight) geom=checkpoint guess=read scrf=(cpcm,solvent=water,read) iop(7/90=-1)

Molecule Name

-5 1

A  15      43      42 R
D  14      15      43      42 R
D  40      15      43      42 R
D  35      42      43      15 R
D  44      42      43      15 R

eps=4.0

