%chk=000231149.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231149

0 1
O 8.494792 0.995394 -0.166948
N -0.425135 -0.465991 0.261486
N 2.464858 -0.533321 0.087689
C 0.270441 -1.744003 -0.097951
C 1.682456 -1.727015 0.549261
C 0.349131 0.727731 -0.204745
C 1.736774 0.721923 0.466163
C -1.843156 -0.427943 -0.217883
C 3.847837 -0.553496 0.671023
C 0.365422 -2.036054 -1.602084
C 4.762475 0.335220 -0.190698
C -2.659023 0.474265 0.730465
C 6.212071 0.268582 0.296583
C -4.114756 0.445502 0.358562
C 7.124775 1.139652 -0.570779
C -4.624047 1.358000 -0.578576
C -4.974275 -0.500081 0.939439
C -5.977159 1.325672 -0.925790
C -6.326468 -0.528096 0.588896
C -6.831367 0.383865 -0.343546
H -0.315722 -2.567653 0.392363
H 2.231896 -2.641058 0.239459
H 1.569636 -1.764484 1.654736
H 0.465714 0.760508 -1.310168
H -0.201005 1.644298 0.097203
H 1.620238 0.838692 1.565929
H 2.325694 1.590192 0.101288
H -1.943994 -0.068871 -1.264163
H -2.268266 -1.455516 -0.195328
H 3.879679 -0.229007 1.732584
H 4.229299 -1.598122 0.649010
H 0.783260 -3.030739 -1.786282
H -0.607761 -1.989510 -2.096565
H 1.033199 -1.317831 -2.098983
H 4.399370 1.381072 -0.178459
H 4.692637 0.009027 -1.249071
H -2.265566 1.510009 0.708151
H -2.506463 0.138280 1.778072
H 6.278547 0.583462 1.355088
H 6.581719 -0.777026 0.274443
H 7.150031 0.803111 -1.624998
H 6.849293 2.207800 -0.530229
H -3.965121 2.092717 -1.035729
H -4.586912 -1.212462 1.665056
H -6.367120 2.036812 -1.651984
H -6.988895 -1.262470 1.044007
H 8.611133 1.267067 0.762717
H -7.884268 0.360996 -0.614310


%chk=000231149-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231149

0 1
O 8.621547 1.047918 -0.137501
N -0.419913 -0.476485 0.251559
N 2.465407 -0.547530 0.073707
C 0.280927 -1.752389 -0.084143
C 1.686206 -1.715691 0.559132
C 0.343958 0.718982 -0.172956
C 1.756657 0.704369 0.436805
C -1.847382 -0.444305 -0.132552
C 3.871201 -0.585395 0.544593
C 0.363621 -2.080853 -1.601769
C 4.797653 0.393921 -0.205765
C -2.693254 0.481230 0.789170
C 6.275268 0.234648 0.220909
C -4.162060 0.469817 0.395542
C 7.206782 1.217901 -0.510289
C -4.645350 1.318205 -0.635040
C -5.074254 -0.424885 1.013063
C -5.999319 1.276113 -1.037248
C -6.429782 -0.471481 0.615274
C -6.897468 0.379167 -0.413337
H -0.287974 -2.561307 0.418181
H 2.234347 -2.639604 0.295338
H 1.563249 -1.687729 1.671861
H 0.427797 0.794780 -1.285142
H -0.184027 1.623572 0.181058
H 1.670963 0.809128 1.549786
H 2.322111 1.571644 0.052345
H -1.999210 -0.125147 -1.193813
H -2.249349 -1.472598 -0.051949
H 3.942319 -0.388274 1.648067
H 4.245714 -1.615099 0.381230
H 0.740308 -3.110790 -1.746590
H -0.629361 -2.017754 -2.083340
H 1.056938 -1.393072 -2.115069
H 4.479673 1.440440 -0.026003
H 4.693216 0.209858 -1.292711
H -2.295792 1.512496 0.733288
H -2.557507 0.135463 1.829992
H 6.363111 0.392987 1.317890
H 6.621957 -0.797556 0.018102
H 7.190256 1.032758 -1.597822
H 6.875321 2.264691 -0.331226
H -3.956299 2.022621 -1.118551
H -4.718812 -1.083948 1.815410
H -6.354747 1.942419 -1.831796
H -7.120299 -1.165494 1.108345
H 8.710193 1.184620 0.839817
H -7.948643 0.346739 -0.721451


