%chk=000182513.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182513

0 1
O 1.374447 1.882929 0.668850
N 1.797653 -0.259024 -0.085206
C -4.754086 -0.393885 -0.072041
C -3.250088 -0.112378 0.013446
C -5.273048 -0.142987 -1.501171
C -5.452233 0.560876 0.915510
C -5.076399 -1.852974 0.302210
C -2.683772 0.937954 -0.729111
C -2.419326 -0.854336 0.868851
C -0.501880 0.461215 0.200144
C -1.321874 1.227286 -0.638079
C -1.054584 -0.574960 0.961599
C 0.952429 0.804817 0.303709
C 3.229062 -0.247612 -0.086248
C 3.974731 0.862134 0.347816
C 3.884232 -1.412106 -0.542094
C 5.368490 0.799554 0.324245
C 5.278566 -1.450939 -0.556392
C 6.025983 -0.350312 -0.124933
H -6.334869 -0.398620 -1.586475
H -5.173585 0.907028 -1.797063
H -4.729636 -0.748281 -2.234773
H -5.257020 1.610185 0.668212
H -6.537576 0.417740 0.907897
H -5.105526 0.399977 1.942321
H -6.146859 -2.059941 0.192739
H -4.540201 -2.558895 -0.341126
H -4.814064 -2.078702 1.341432
H -3.312327 1.544996 -1.381751
H -2.836268 -1.656048 1.478715
H -0.895506 2.053235 -1.210182
H -0.426164 -1.155124 1.637659
H 1.360986 -1.121488 -0.420818
H 3.468870 1.767466 0.699631
H 3.317378 -2.274252 -0.881352
H 5.947503 1.659874 0.660788
H 5.787237 -2.348196 -0.907680
H 7.112021 -0.388308 -0.139084


%chk=000182513-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182513

0 1
O 1.352399 2.034779 0.096372
N 1.877397 -0.249098 -0.073571
C -4.817261 -0.393595 -0.039410
C -3.294463 -0.127736 -0.006098
C -5.349413 -0.139192 -1.482849
C -5.529259 0.577317 0.951158
C -5.174512 -1.847480 0.361875
C -2.789646 1.156694 -0.357980
C -2.349679 -1.113647 0.377413
C -0.473995 0.438031 0.023819
C -1.412946 1.437838 -0.339208
C -0.964288 -0.839478 0.394038
C 0.983549 0.820699 0.026503
C 3.300114 -0.229408 -0.042481
C 4.060261 0.960228 0.124114
C 3.969481 -1.476652 -0.183656
C 5.469447 0.880143 0.151109
C 5.376629 -1.537915 -0.156668
C 6.138198 -0.357592 0.012463
H -6.440892 -0.314770 -1.522458
H -5.161310 0.898345 -1.811201
H -4.862681 -0.817343 -2.207572
H -5.337701 1.634805 0.696311
H -6.622970 0.413787 0.923621
H -5.179782 0.409775 1.986307
H -6.270309 -1.983338 0.315498
H -4.717023 -2.586478 -0.321789
H -4.853119 -2.078668 1.394242
H -3.484481 1.952407 -0.650342
H -2.689113 -2.108341 0.679944
H -1.032659 2.431853 -0.596155
H -0.284148 -1.626415 0.745338
H 1.460877 -1.170056 -0.225740
H 3.541571 1.914988 0.223006
H 3.386148 -2.398164 -0.313370
H 6.048768 1.801353 0.280392
H 5.877359 -2.506220 -0.266740
H 7.232154 -0.403560 0.033959


