%chk=000193974.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193974

0 1
O -0.427030 -0.258645 -0.245236
N -2.942369 0.156646 0.769397
N -3.637989 -1.561273 -0.644450
C 0.789738 2.164070 -0.295644
C -0.049459 2.717062 0.851365
C 1.189140 3.460084 0.395925
C 1.583013 0.922701 -0.113250
C 0.941469 -0.342969 -0.087209
C 2.973258 0.940431 0.003423
C 1.650996 -1.534789 0.062452
C 3.706136 -0.243637 0.154180
C 3.051787 -1.480299 0.186511
C -1.209374 -1.481207 -0.100552
C -2.624622 -0.984037 -0.052545
C -4.392295 0.448424 0.504988
C -4.861570 -0.760858 -0.362149
C 3.822066 -2.750223 0.347007
H 0.368491 2.231008 -1.310656
H -0.039597 2.203817 1.811229
H -1.030942 3.132532 0.643704
H 1.087819 4.400935 -0.138963
H 2.061797 3.481455 1.044946
H 3.500297 1.895531 -0.025077
H 1.151151 -2.496508 0.077642
H 4.787882 -0.194247 0.244594
H -1.021236 -2.126905 -0.980794
H -0.934658 -1.998642 0.839526
H -4.549995 1.415616 -0.003283
H -4.917464 0.482772 1.480404
H -5.597343 -1.393022 0.173646
H -5.323602 -0.450946 -1.319418
H -2.300976 0.948458 0.706247
H 3.496089 -3.305204 1.238606
H 3.679689 -3.413934 -0.518418
H 4.902303 -2.583196 0.449452


%chk=000193974-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193974

0 1
O -0.477665 -0.176605 -0.154945
N -3.102998 0.175991 0.488630
N -3.672526 -1.779541 -0.604019
C 0.816904 2.256942 -0.124614
C 0.274575 2.969714 1.137830
C 1.386021 3.615086 0.295303
C 1.606643 0.985774 -0.013787
C 0.923996 -0.267999 -0.034536
C 3.013017 0.949425 0.096731
C 1.620615 -1.491584 0.053571
C 3.722891 -0.271811 0.193718
C 3.035915 -1.506624 0.172418
C -1.261802 -1.421645 -0.101845
C -2.713619 -1.021357 -0.111205
C -4.549897 0.378857 0.238365
C -4.956859 -1.044297 -0.307851
C 3.779985 -2.828444 0.264175
H 0.125189 2.271691 -0.975324
H 0.555397 2.552813 2.109432
H -0.729688 3.403469 1.096130
H 1.132680 4.486914 -0.314632
H 2.387226 3.653604 0.734141
H 3.565902 1.895132 0.092757
H 1.082174 -2.444973 0.025232
H 4.815591 -0.261552 0.276577
H -1.054568 -2.070317 -0.972022
H -1.020437 -1.974018 0.829727
H -4.720994 1.175831 -0.513822
H -5.090882 0.646410 1.162949
H -5.528558 -1.616376 0.447286
H -5.571581 -0.985041 -1.222112
H -2.432811 0.925955 0.659721
H 3.449077 -3.418676 1.139575
H 3.605809 -3.451870 -0.633213
H 4.867878 -2.669879 0.357258


