%chk=000209642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209642

0 1
O 1.192519 2.406752 -0.906278
N -3.712218 1.324711 0.135115
N -0.086963 0.583332 -0.188818
N 2.141513 0.293039 -0.951536
C -1.235815 1.478833 0.101293
C -1.758557 1.463623 1.564151
C -2.524572 1.205102 -0.769911
C -3.203501 1.991944 1.373303
C -4.422036 0.038250 0.371329
C -0.192265 -0.840374 0.025459
C 1.095947 1.168410 -0.697124
C -5.273493 -0.374978 -0.844016
C 0.077758 -1.396403 1.303461
C -0.550809 -1.700867 -1.045914
C 3.441552 0.786727 -1.434167
C 4.456526 1.081658 -0.303738
C -0.026651 -2.790761 1.509954
C -0.649018 -3.095269 -0.838029
C 4.857902 -0.161380 0.521631
C -0.392017 -3.642494 0.441014
C 5.897373 0.160917 1.617109
H -0.847858 2.486146 -0.132377
H -1.788371 0.433971 1.966080
H -1.140003 2.088953 2.231204
H -2.490973 0.195168 -1.218091
H -2.580094 1.938996 -1.594834
H -3.185171 3.088692 1.212934
H -3.870258 1.785498 2.227711
H -5.089000 0.183123 1.242208
H -3.721770 -0.796944 0.629906
H -6.006646 0.416166 -1.078697
H -4.645942 -0.532392 -1.740480
H -5.814240 -1.318351 -0.640097
H 2.033453 -0.696994 -0.730938
H 0.378411 -0.730093 2.118995
H -0.734000 -1.268487 -2.035697
H 3.859824 0.034950 -2.132404
H 3.244522 1.712680 -2.001324
H 5.364522 1.524733 -0.762930
H 4.026836 1.855137 0.362133
H 0.182096 -3.211498 2.499832
H -0.924930 -3.751753 -1.670647
H 3.953508 -0.597986 0.992740
H 5.266484 -0.937649 -0.158941
H -0.470662 -4.723268 0.602091
H 5.504883 0.916157 2.323871
H 6.167592 -0.739775 2.198736
H 6.825613 0.569048 1.174530


%chk=000209642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209642

0 1
O 0.870948 2.288969 -0.906017
N -3.728800 1.208307 0.205974
N -0.126540 0.327092 -0.063999
N 2.090682 0.298371 -0.916610
C -1.379708 1.066996 0.223596
C -1.848766 1.039549 1.716325
C -2.627324 0.589805 -0.564121
C -3.400258 0.968462 1.641306
C -5.096733 0.799969 -0.167125
C 0.009074 -1.065991 0.293094
C 0.950122 1.046860 -0.642554
C -5.481650 1.228842 -1.594753
C 0.621304 -1.427814 1.522576
C -0.450304 -2.085700 -0.580642
C 3.299996 0.926320 -1.471538
C 4.395812 1.204244 -0.414116
C 0.761593 -2.788716 1.877138
C -0.311406 -3.446037 -0.222501
C 4.965637 -0.072293 0.245090
C 0.292356 -3.800579 1.006861
C 6.063077 0.232255 1.287723
H -1.161149 2.104913 -0.075770
H -1.445476 0.157243 2.242202
H -1.494930 1.940096 2.245188
H -2.692782 -0.529694 -0.567526
H -2.611504 0.944167 -1.608348
H -3.900706 1.722958 2.274829
H -3.752746 -0.041022 1.975021
H -5.791277 1.275451 0.552853
H -5.233162 -0.310016 -0.058956
H -5.342688 2.317576 -1.715400
H -4.866404 0.716675 -2.356383
H -6.540038 0.983332 -1.798165
H 2.106416 -0.694741 -0.684026
H 0.985002 -0.635507 2.186319
H -0.898601 -1.802869 -1.538868
H 3.705609 0.271581 -2.268692
H 2.978530 1.874601 -1.935053
H 5.220177 1.759952 -0.907157
H 3.978699 1.875073 0.362249
H 1.233284 -3.057931 2.828714
H -0.669351 -4.226701 -0.902860
H 4.142034 -0.631656 0.734681
H 5.375752 -0.738252 -0.542600
H 0.398942 -4.855497 1.282598
H 5.668310 0.870308 2.100630
H 6.458292 -0.693783 1.744569
H 6.911656 0.769833 0.824044


