%mem=16000MB
%nprocshared=12
#p opt freq b3lyp 6-311+g(d) scrf=(smd,solvent=dichloromethane) nosymm empiricaldispersion=gd3

c5h5n_6311+Gd_new

0 1
 N	 0.000187000	-0.022650000	 0.805410000
 C	-1.144470000	-0.019900000	 1.506411000
 C	 1.144824000	-0.009591000	 1.506329000
 C	-1.197175000	-0.004448000	 2.897797000
 H	-2.061802000	-0.030344000	 0.925810000
 C	 1.197485000	 0.006370000	 2.897711000
 H	 2.062172000	-0.011876000	 0.925663000
 C	 0.000144000	 0.008888000	 3.609889000
 H	-2.155085000	-0.003019000	 3.405393000
 H	 2.155379000	 0.016455000	 3.405240000
 H	 0.000127000	 0.021053000	 4.694612000



