%chk=000251559.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251559

0 1
O 0.646403 -1.798612 -1.497010
N -0.384275 0.127040 1.069912
N 2.014768 -2.545049 0.141808
C -4.130649 0.045701 -0.796362
C -3.944818 0.005869 0.725474
C -2.948934 0.755207 -1.469315
C -2.636685 -0.695967 1.109041
C -1.613467 0.098545 -1.109716
C -1.452063 -0.108226 0.375555
C 2.365863 2.628860 0.292929
C 1.151120 2.034593 1.016090
C 3.512015 1.612340 0.227862
C 0.846795 0.628511 0.563383
C 3.081834 0.355373 -0.542464
C 1.726666 -0.137080 -0.120619
C 1.388967 -1.516881 -0.566202
H -4.226362 -0.983844 -1.192566
H -5.075930 0.560389 -1.050031
H -4.797941 -0.514215 1.200701
H -3.948289 1.035876 1.133237
H -2.931789 1.821488 -1.170158
H -3.078830 0.747832 -2.568817
H -2.691996 -1.777764 0.861134
H -2.485177 -0.647761 2.208345
H -0.772124 0.686277 -1.532061
H -1.510123 -0.897034 -1.608315
H 2.079054 2.934941 -0.732385
H 2.696920 3.549182 0.808698
H 0.264330 2.684936 0.873287
H 1.326964 2.013889 2.114744
H 3.825097 1.334829 1.253005
H 4.398178 2.064678 -0.254003
H 3.841811 -0.440971 -0.410960
H 3.052334 0.570775 -1.633094
H 1.792623 -3.505289 -0.065781
H 2.522608 -2.374937 0.991358


%chk=000251559-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251559

0 1
O 0.270841 -2.173308 -0.293094
N -0.469118 0.237182 1.042719
N 2.511426 -2.440735 -0.737361
C -4.257526 0.074604 -0.817594
C -4.080414 0.192406 0.714162
C -3.034283 0.661166 -1.560087
C -2.777124 -0.504864 1.186898
C -1.713932 -0.020334 -1.112206
C -1.560298 -0.051325 0.400592
C 2.392399 2.591464 0.261486
C 1.086961 2.079934 0.897019
C 3.522279 1.587825 0.553746
C 0.793264 0.609331 0.586396
C 3.212517 0.224487 -0.103848
C 1.761962 -0.244884 0.067065
C 1.438919 -1.650368 -0.309059
H -4.376647 -0.993696 -1.092606
H -5.181736 0.594382 -1.136229
H -4.946944 -0.252054 1.239781
H -4.047131 1.264095 0.997320
H -2.975826 1.750629 -1.359366
H -3.152959 0.542911 -2.654236
H -2.875842 -1.599245 1.026667
H -2.593517 -0.345165 2.262874
H -0.833161 0.463559 -1.572798
H -1.696989 -1.079155 -1.440887
H 2.266433 2.699610 -0.834277
H 2.636959 3.593041 0.662562
H 0.219263 2.679807 0.557902
H 1.124773 2.201770 1.998319
H 3.612846 1.459583 1.650781
H 4.496018 1.965137 0.187886
H 3.902188 -0.524878 0.340519
H 3.461434 0.277742 -1.186094
H 2.292637 -3.397728 -1.009469
H 3.475226 -2.119425 -0.768782


