%chk=000219403.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219403

0 1
O 3.126586 -1.580267 0.003249
O -5.207239 -0.660399 0.001410
N 2.501886 0.641997 -0.001014
N -3.825442 -0.833216 0.001720
C 1.080211 0.497364 -0.001039
C -1.724404 0.345996 -0.001135
C 0.308633 1.681222 -0.004602
C 0.445677 -0.757098 0.002416
C -1.080473 1.597305 -0.004606
C -0.945382 -0.825157 0.002350
C 3.449898 -0.411674 0.001067
C -3.196205 0.308859 -0.001287
C 4.875734 0.065194 0.000398
H 0.786902 2.657289 -0.007366
H 1.038892 -1.679399 0.005077
H -1.670230 2.514657 -0.007366
H -1.435888 -1.802938 0.005034
H 2.846605 1.604130 -0.002938
H -3.706323 1.287035 -0.003644
H 5.123044 0.658620 -0.889710
H 5.557045 -0.803792 0.001628
H 5.122945 0.661044 0.888936
H -5.553072 -1.613673 0.004022


%chk=000219403-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219403

0 1
O 3.247575 -1.652137 0.004381
O -5.314780 -0.563275 0.000842
N 2.519173 0.583915 -0.001094
N -3.880421 -0.838603 0.001819
C 1.105521 0.445383 -0.000892
C -1.746056 0.318045 -0.000892
C 0.329057 1.636863 -0.004230
C 0.446064 -0.817934 0.002493
C -1.074496 1.572359 -0.004209
C -0.957689 -0.868407 0.002444
C 3.504354 -0.413171 0.001402
C -3.211955 0.297571 -0.001052
C 4.930922 0.141799 0.000051
H 0.828051 2.615385 -0.006883
H 1.043456 -1.730922 0.005052
H -1.658095 2.501063 -0.006821
H -1.466481 -1.837795 0.005035
H 2.862944 1.547780 -0.003453
H -3.747929 1.261577 -0.003708
H 5.118649 0.760928 -0.897227
H 5.635810 -0.701657 0.001564
H 5.118924 0.764338 0.894908
H -5.713198 -1.470004 0.003071


