%chk=000253349.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253349

0 1
O 3.706783 -0.364793 0.081700
O 2.878096 1.664382 -0.479431
N -0.852420 -0.362443 0.070144
N -0.212378 -1.591194 0.306227
N 1.053573 -1.438799 0.275809
N -0.053407 1.976882 -0.302924
C -2.285249 -0.215459 0.062155
C 0.142309 0.620639 -0.127381
C 1.369653 -0.092413 0.002295
C -2.873502 0.909541 0.662751
C -3.066986 -1.213846 -0.543201
C 2.684247 0.499520 -0.155884
C -4.263936 1.040754 0.627717
C -4.455183 -1.064728 -0.559125
C -5.053829 0.061448 0.016597
C 5.069148 0.184253 -0.070841
C 5.954403 -0.996196 0.260434
H -2.265404 1.655406 1.175658
H -2.594780 -2.096596 -0.980098
H -4.733848 1.909805 1.089456
H -5.073800 -1.833871 -1.023470
H 0.797935 2.500754 -0.550093
H -0.889903 2.281238 -0.783935
H -6.137567 0.171397 -0.004208
H 5.171861 0.541362 -1.109526
H 5.170460 1.028948 0.631667
H 7.015594 -0.733010 0.186611
H 5.763094 -1.366604 1.278198
H 5.762934 -1.842276 -0.415603


%chk=000253349-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253349

0 1
O 3.709163 -0.430053 0.093566
O 2.799401 1.680055 -0.340315
N -0.882732 -0.343149 0.077201
N -0.291571 -1.680531 0.326428
N 1.019313 -1.508564 0.302459
N 0.013926 1.902874 -0.385532
C -2.299866 -0.185003 0.046054
C 0.127368 0.574933 -0.097022
C 1.337235 -0.169887 0.051216
C -2.909189 0.978773 0.580368
C -3.091961 -1.224796 -0.499526
C 2.649738 0.438885 -0.080407
C -4.314174 1.112005 0.532658
C -4.494747 -1.084978 -0.525796
C -5.111344 0.085124 -0.022309
C 5.074512 0.166863 -0.040315
C 6.064746 -0.970834 0.181879
H -2.303240 1.746685 1.074212
H -2.600657 -2.123063 -0.883054
H -4.784956 2.009902 0.947400
H -5.107618 -1.890090 -0.944901
H 0.909815 2.392037 -0.512843
H -0.879075 2.347258 -0.582439
H -6.200850 0.190058 -0.052755
H 5.160716 0.616836 -1.046006
H 5.176577 0.973332 0.708342
H 7.098895 -0.589866 0.096813
H 5.936033 -1.413268 1.184193
H 5.922440 -1.767438 -0.567871


