%chk=000230618.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230618

0 1
O 0.457527 -1.369450 -1.682872
N -1.315410 0.578112 0.201812
C -0.666414 -0.770658 0.375323
C -1.871783 0.788902 -1.179444
C -2.372331 0.869136 1.227591
C -1.615553 -1.952291 0.049999
C -2.284155 2.261374 -1.342124
C -2.808527 2.340680 1.110541
C -3.332323 2.656938 -0.295295
C -0.100248 -0.902285 1.797438
C 0.532948 -0.774392 -0.629637
C -0.998117 -3.336972 0.286358
C 1.785360 -0.048350 -0.249176
C -1.969382 -4.451800 -0.098091
C 3.013871 -0.713784 -0.377919
C 1.748915 1.281996 0.187449
C 4.200594 -0.054427 -0.048691
C 2.940413 1.940839 0.505106
C 4.163960 1.273062 0.392388
H -2.739070 0.128442 -1.395985
H -1.087900 0.540689 -1.928506
H -1.950526 0.698004 2.240272
H -3.255496 0.202076 1.126001
H -1.923440 -1.884678 -1.015209
H -2.541112 -1.850807 0.646160
H -2.673605 2.424983 -2.363486
H -1.390601 2.908924 -1.240885
H -1.946713 2.997960 1.342058
H -3.581273 2.558022 1.869864
H -3.571372 3.732882 -0.380963
H -4.279391 2.115909 -0.480709
H -0.877678 -1.167644 2.521944
H 0.670526 -1.680562 1.849131
H 0.365925 0.033831 2.135317
H -0.701810 -3.454574 1.345851
H -0.068890 -3.433779 -0.312802
H -1.525216 -5.438426 0.075361
H -2.240139 -4.399703 -1.159594
H -2.897404 -4.401389 0.481286
H 3.037906 -1.740787 -0.744109
H 0.788447 1.801400 0.275135
H 5.153607 -0.571424 -0.143086
H 2.913699 2.976030 0.840014
H 5.090077 1.787489 0.644284


%chk=000230618-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230618

0 1
O 0.765409 -1.871245 -1.290928
N -1.279555 0.467669 0.266013
C -0.657258 -0.897034 0.459741
C -1.645760 0.772792 -1.145487
C -2.390848 0.814049 1.190342
C -1.630580 -2.049391 0.038238
C -1.952337 2.274967 -1.316894
C -2.729116 2.318897 1.091400
C -3.083923 2.712007 -0.359929
C -0.214354 -1.074456 1.941705
C 0.644916 -0.959467 -0.418613
C -1.233917 -3.488502 0.445983
C 1.795264 -0.008374 -0.196210
C -2.246994 -4.526610 -0.085405
C 3.067857 -0.406821 -0.696244
C 1.677665 1.248230 0.460916
C 4.196428 0.419298 -0.532169
C 2.809212 2.077733 0.615817
C 4.071003 1.666846 0.126433
H -2.539681 0.186012 -1.474082
H -0.807090 0.482651 -1.803884
H -2.092879 0.574065 2.224765
H -3.318023 0.226984 0.965036
H -1.743819 -2.029198 -1.061860
H -2.624703 -1.822603 0.476526
H -2.232643 2.472774 -2.369503
H -1.034717 2.856185 -1.100687
H -1.851949 2.905127 1.429525
H -3.569087 2.548377 1.775650
H -3.261697 3.801403 -0.436242
H -4.028237 2.208602 -0.654972
H -1.078188 -1.312210 2.587188
H 0.502573 -1.908326 2.033383
H 0.276033 -0.163570 2.321947
H -1.174844 -3.573678 1.548735
H -0.230742 -3.718197 0.043721
H -1.972711 -5.552349 0.223345
H -2.287235 -4.506137 -1.190615
H -3.267230 -4.321002 0.292601
H 3.142268 -1.369851 -1.212063
H 0.684750 1.565242 0.795754
H 5.171039 0.096653 -0.914985
H 2.706024 3.048885 1.113045
H 4.947570 2.313074 0.251062


