%chk=000279629.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279629

0 1
O 2.101149 1.387661 -1.672909
O 4.390213 1.022732 -2.271563
N 4.589396 -1.810850 0.339261
N 3.007100 -0.604252 -1.178514
N 1.677254 -0.646068 -0.717714
N -2.931794 1.556125 -0.093955
C 5.610846 -0.796167 0.693144
C 3.783193 -2.124151 1.551513
C 6.051132 -1.265407 2.095171
C 4.730561 -1.786368 2.745865
C 3.951050 -1.767447 -0.939958
C 3.347027 0.608328 -1.769086
C 1.166965 0.550970 -1.028246
C -0.209390 0.975684 -0.749363
C -0.749547 2.277708 -1.082519
C -1.038369 0.035196 -0.114020
C -2.140776 2.501809 -0.717597
C -2.399156 0.343089 0.204042
C -0.034317 3.339595 -1.727781
C -3.295307 -0.645352 0.876015
C -2.752761 3.764751 -1.009995
C -0.662447 4.559106 -1.998099
C -2.029076 4.777403 -1.639055
C -4.618113 -0.256398 1.226300
C -2.877942 -1.970497 1.179401
C -5.492774 -1.159989 1.860976
C -3.754811 -2.875591 1.814746
C -5.066215 -2.476134 2.159984
H 5.191785 0.236693 0.740123
H 6.428041 -0.794953 -0.049581
H 3.478405 -3.187199 1.532088
H 2.857187 -1.511064 1.603697
H 6.518756 -0.455893 2.681154
H 6.780498 -2.087931 1.995771
H 4.917805 -2.667042 3.382699
H 4.275928 -1.007864 3.383242
H 4.705183 -1.682454 -1.741556
H 3.335966 -2.669724 -1.094005
H -0.614497 -0.939942 0.133098
H 1.008992 3.192585 -2.010359
H -3.799900 3.890867 -0.719363
H -0.098543 5.357666 -2.492437
H -2.503004 5.739935 -1.859890
H -4.931454 0.763456 0.985281
H -1.871498 -2.314909 0.919939
H -6.507525 -0.840477 2.123472
H -3.414905 -3.892998 2.038316
H -5.745707 -3.180142 2.653161


%chk=000279629-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279629

0 1
O 2.095380 1.350529 -1.708787
O 4.379895 0.970999 -2.350790
N 4.588983 -1.837090 0.315086
N 3.003292 -0.639323 -1.204696
N 1.683122 -0.666929 -0.715327
N -2.911094 1.556253 -0.053152
C 5.659595 -0.860951 0.637716
C 3.808700 -2.190504 1.539568
C 5.991322 -1.211699 2.102333
C 4.592514 -1.520172 2.704641
C 3.947872 -1.806179 -0.958417
C 3.337631 0.564006 -1.818711
C 1.171310 0.527470 -1.033050
C -0.199107 0.960234 -0.737483
C -0.727213 2.274596 -1.040264
C -1.034562 0.015742 -0.116773
C -2.113835 2.505888 -0.662651
C -2.389606 0.332008 0.217362
C -0.003983 3.342208 -1.666908
C -3.292771 -0.660434 0.874043
C -2.713783 3.781113 -0.925162
C -0.620235 4.573919 -1.907698
C -1.982544 4.799082 -1.536706
C -4.620535 -0.274678 1.208885
C -2.877410 -1.986010 1.178290
C -5.502256 -1.182086 1.828141
C -3.761237 -2.894870 1.798443
C -5.077861 -2.498883 2.127384
H 5.315923 0.196491 0.560127
H 6.517841 -0.986879 -0.047075
H 3.765984 -3.291947 1.651433
H 2.766961 -1.814533 1.488121
H 6.510495 -0.391425 2.626288
H 6.633316 -2.110334 2.135144
H 4.647396 -2.165070 3.597579
H 4.097139 -0.577342 3.000138
H 4.695729 -1.727729 -1.766775
H 3.327546 -2.705815 -1.106230
H -0.621082 -0.970236 0.103366
H 1.035486 3.189131 -1.960204
H -3.757873 3.912384 -0.625957
H -0.050405 5.376674 -2.388268
H -2.447247 5.771077 -1.734581
H -4.931761 0.745997 0.968627
H -1.866228 -2.327290 0.933584
H -6.520934 -0.865099 2.078226
H -3.422421 -3.912324 2.023472
H -5.762843 -3.205876 2.608560


