%chk=000260603.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260603

0 1
O -0.984203 -4.636808 0.051629
N 5.447807 0.855944 -0.507451
N -4.059617 3.386566 -0.110678
N -0.306733 -1.956441 0.219591
N -1.610069 -2.380569 0.378960
N -3.232277 -4.127164 0.267060
N -3.539465 -5.518564 0.368805
C 1.385667 -0.301568 -0.035627
C -1.049584 0.407751 0.049681
C -0.038576 -0.681487 0.088697
C 4.108307 0.438415 -0.263123
C -2.984150 2.460798 -0.038343
C 1.809901 0.987572 0.329921
C -1.327289 1.067189 -1.156802
C 2.340264 -1.218891 -0.512601
C -1.731639 0.787878 1.214607
C 3.146456 1.356435 0.224156
C -2.279852 2.079145 -1.207209
C 3.679039 -0.860552 -0.625649
C -2.683938 1.800921 1.179241
C 5.942178 2.012693 0.289456
C 6.474618 -0.217897 -0.607053
C -4.066668 4.324994 -1.265957
C -4.451717 4.065581 1.154554
C -1.825149 -3.780250 0.223352
H 1.083916 1.711070 0.706084
H -0.786606 0.783752 -2.062176
H 2.026205 -2.230109 -0.790984
H -1.507496 0.287312 2.158586
H 3.441447 2.363255 0.508966
H -2.483306 2.567072 -2.157858
H 4.389171 -1.591682 -1.005326
H -3.202402 2.073428 2.095700
H 5.273482 2.878654 0.138222
H 6.938545 2.310836 -0.075690
H 6.011447 1.808651 1.369423
H 6.623600 -0.776941 0.330067
H 7.438479 0.221870 -0.910682
H 6.185606 -0.932415 -1.398662
H -5.008545 4.898274 -1.268727
H -3.225013 5.035384 -1.263989
H -4.040603 3.751435 -2.209865
H -5.370691 4.651717 0.987701
H -4.691468 3.309513 1.923427
H -3.676065 4.737786 1.553975
H -2.391657 -1.729024 0.206124
H -3.829001 -3.608678 0.930451
H -3.649358 -5.876542 -0.590866
H -2.753201 -6.052113 0.773485


%chk=000260603-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260603

0 1
O -1.096528 -4.640417 0.495762
N 5.668128 0.710962 -0.301144
N -4.003559 3.463311 0.032038
N -0.207713 -1.949400 0.197694
N -1.542884 -2.323010 0.217739
N -3.286143 -3.873105 0.193934
N -3.857419 -5.165658 0.270620
C 1.507682 -0.290604 -0.007881
C -0.975396 0.424601 0.092321
C 0.075038 -0.649610 0.104079
C 4.310583 0.385969 -0.201252
C -3.017315 2.472888 0.052819
C 1.956797 1.051507 0.129455
C -1.132775 1.291471 -1.022491
C 2.497780 -1.290134 -0.240722
C -1.860508 0.609713 1.190335
C 3.318745 1.389090 0.036545
C -2.124764 2.287310 -1.053111
C 3.858044 -0.969107 -0.334759
C -2.854825 1.606108 1.181781
C 6.101535 2.103691 -0.146506
C 6.664876 -0.344858 -0.517626
C -4.129192 4.350772 -1.130807
C -4.891798 3.641255 1.187391
C -1.892498 -3.681398 0.313179
H 1.228893 1.846045 0.327157
H -0.462919 1.178079 -1.882630
H 2.168347 -2.329207 -0.340138
H -1.746513 -0.018251 2.082487
H 3.609548 2.436572 0.157140
H -2.202841 2.924426 -1.938354
H 4.576157 -1.774165 -0.515320
H -3.496391 1.716222 2.060401
H 5.635699 2.764866 -0.905687
H 7.194323 2.164465 -0.271107
H 5.849118 2.507945 0.855920
H 6.666457 -1.088393 0.305780
H 7.669185 0.104872 -0.570411
H 6.486718 -0.890422 -1.466614
H -4.958124 5.056621 -0.965060
H -3.206648 4.943041 -1.301284
H -4.346530 3.784740 -2.059508
H -5.598728 4.460640 0.983213
H -5.483700 2.726747 1.395969
H -4.328619 3.899322 2.107950
H -2.277362 -1.603496 0.140321
H -3.924035 -3.131264 -0.096176
H -3.413846 -5.800193 -0.409452
H -3.764285 -5.546362 1.222614


