%chk=000287737.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287737

0 1
O -1.791283 0.224427 0.941673
N -4.852611 0.779778 0.188094
N 1.291714 1.854895 1.038253
N -0.053320 1.882882 1.279661
C -6.253841 0.241052 0.228226
C -4.241271 0.190999 -1.051102
C -6.284139 -1.091702 -0.552496
C -4.991555 -1.116630 -1.388741
C -4.081460 0.416012 1.420508
C 0.370640 -1.537892 -0.162364
C 0.562963 -0.168768 0.369860
C -2.771253 1.203926 1.454642
C 1.633651 -2.182972 -0.744599
C 2.410710 -1.235294 -1.673618
C 1.711700 0.630412 0.489900
C 3.461170 -0.482197 -0.906923
C 3.111701 0.383306 0.153288
C -0.507449 0.652021 0.878940
C 4.815274 -0.662032 -1.230604
C 4.130021 1.016690 0.890238
C 5.814826 -0.008563 -0.508824
C 5.471759 0.825824 0.559849
H -6.893112 1.001799 -0.269993
H -6.632202 0.130261 1.259045
H -3.150871 0.027519 -0.933562
H -4.373471 0.943124 -1.856681
H -7.179362 -1.156896 -1.190951
H -6.326805 -1.952922 0.133863
H -4.378066 -1.998373 -1.141179
H -5.209365 -1.180527 -2.466531
H -3.858567 -0.673692 1.497974
H -4.691294 0.685693 2.310408
H -0.036388 -2.186938 0.645707
H -0.426964 -1.504675 -0.939075
H -2.465506 1.490458 2.473693
H -2.761646 2.086328 0.790078
H 1.350481 -3.097693 -1.299624
H 2.292936 -2.523590 0.079350
H 1.714096 -0.518005 -2.159658
H 2.862314 -1.812137 -2.504094
H 1.848977 2.672254 1.227028
H 5.090038 -1.322634 -2.051942
H 3.878902 1.650083 1.739632
H 6.861181 -0.154159 -0.772876
H 6.250046 1.322750 1.135927


%chk=000287737-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287737

0 1
O -1.799947 0.223324 0.736477
N -4.805419 0.752545 -0.013249
N 1.338271 1.667619 1.252345
N -0.039725 1.722331 1.435681
C -6.283443 0.545988 0.010070
C -4.352093 -0.195978 -1.078944
C -6.518763 -0.991629 -0.164082
C -5.268817 -1.470143 -0.974185
C -4.157019 0.543568 1.309185
C 0.389495 -1.434249 -0.588599
C 0.587503 -0.153823 0.183312
C -2.757176 1.150379 1.402132
C 1.688077 -2.102602 -1.089103
C 2.635175 -1.113600 -1.833431
C 1.762266 0.570349 0.499388
C 3.625157 -0.415217 -0.913409
C 3.190953 0.359005 0.209250
C -0.470230 0.600472 0.787567
C 5.014770 -0.549977 -1.150492
C 4.170704 0.956031 1.055043
C 5.977426 0.064046 -0.318880
C 5.548515 0.819799 0.795353
H -6.721032 1.089289 -0.850232
H -6.726420 0.960743 0.932012
H -3.280835 -0.416430 -0.960129
H -4.501657 0.293179 -2.060431
H -7.468258 -1.207356 -0.685190
H -6.559532 -1.489137 0.821900
H -4.749578 -2.293612 -0.452676
H -5.547048 -1.839984 -1.977167
H -4.095105 -0.528290 1.619006
H -4.778997 1.064284 2.062446
H -0.178428 -2.152891 0.035937
H -0.266444 -1.221084 -1.458503
H -2.440679 1.269445 2.456488
H -2.720280 2.133162 0.898425
H 1.410312 -2.928109 -1.771810
H 2.234850 -2.560252 -0.242918
H 2.011547 -0.364281 -2.363235
H 3.203194 -1.657614 -2.610079
H 1.897580 2.458341 1.559888
H 5.344465 -1.146524 -2.009824
H 3.854009 1.502222 1.951768
H 7.045561 -0.054450 -0.531112
H 6.280395 1.285311 1.464404


