%chk=000197291.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197291

0 1
O 5.431861 0.919960 0.045056
O 4.921183 -1.637443 -0.700207
N 1.792863 -0.081991 0.456105
C 3.275615 -0.254528 0.362297
C 4.019130 1.025426 -0.124414
C 3.492627 -1.417109 -0.647979
C 1.147977 0.686831 -0.650883
C 3.802620 -0.661139 1.743490
C -0.350911 0.693066 -0.452576
C -1.033489 -0.453444 -0.116991
C -2.453812 -0.433249 0.044705
C -1.062367 1.918774 -0.646830
C -3.158480 0.782836 -0.150936
C -2.425435 1.960916 -0.501947
C -3.184285 -1.612994 0.398485
C -4.580642 0.800654 0.008411
C -4.547823 -1.567573 0.545124
C -5.255485 -0.345200 0.347302
H 1.527466 0.324015 1.360543
H 3.758727 1.906970 0.489875
H 3.813756 1.240257 -1.187828
H 3.012891 -2.346555 -0.292161
H 3.126345 -1.168319 -1.656432
H 1.380015 0.182144 -1.618379
H 1.529452 1.728806 -0.739682
H 3.769607 0.165081 2.460924
H 4.859178 -0.966364 1.662015
H 3.247738 -1.507505 2.163043
H -0.496189 -1.390879 0.038780
H -0.506905 2.816922 -0.911158
H -2.972849 2.891029 -0.649759
H 5.751723 0.051259 -0.324911
H 5.142252 -2.216273 -1.452945
H -2.634782 -2.541110 0.548430
H -5.111879 1.738703 -0.144212
H -5.111285 -2.459589 0.814234
H -6.337110 -0.341684 0.470911


%chk=000197291-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197291

0 1
O 5.609186 0.708945 -0.005651
O 4.787091 -1.618759 -1.060047
N 1.862659 0.069668 0.539129
C 3.303809 -0.270310 0.374719
C 4.172402 0.970705 -0.025463
C 3.365182 -1.360447 -0.729253
C 1.192456 0.962820 -0.425412
C 3.806163 -0.852592 1.713290
C -0.331245 0.865496 -0.344078
C -0.972973 -0.281352 0.132621
C -2.403187 -0.373631 0.172510
C -1.125619 1.974469 -0.793591
C -3.197762 0.746016 -0.292302
C -2.519039 1.914941 -0.772819
C -3.076935 -1.544623 0.656529
C -4.628346 0.652204 -0.254084
C -4.472310 -1.609493 0.680963
C -5.255564 -0.501759 0.221981
H 1.631363 0.304635 1.511518
H 4.002610 1.780240 0.708398
H 3.855632 1.336454 -1.028698
H 2.879676 -2.280621 -0.351053
H 2.830072 -1.013803 -1.637201
H 1.511075 0.672034 -1.447000
H 1.479935 2.035790 -0.316959
H 3.823704 -0.070694 2.495638
H 4.831483 -1.239412 1.606845
H 3.143197 -1.673830 2.043155
H -0.358929 -1.120124 0.479437
H -0.621581 2.879721 -1.155400
H -3.113797 2.768896 -1.119214
H 5.736028 -0.143085 -0.513591
H 4.859547 -2.293364 -1.777032
H -2.476810 -2.392401 1.008693
H -5.225176 1.502492 -0.606219
H -4.975613 -2.509099 1.052316
H -6.349088 -0.565425 0.246824


