%chk=000226195.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226195

0 1
O -0.057493 -0.570697 -0.021649
N 3.594257 0.112238 -0.088528
C -2.424034 -1.105111 -0.210501
C -2.845763 0.198212 0.519826
C -1.100449 -0.943978 -0.977602
C -3.092072 1.412354 -0.404725
C -2.344873 -2.293328 0.777132
C 1.242968 -0.431553 -0.665210
C 2.233593 -0.071442 0.445208
C -3.668931 2.625765 0.356975
C 4.636119 -0.126850 0.927360
C 3.777857 1.409783 -0.767741
H -3.195202 -1.334828 -0.977810
H -3.775823 -0.009402 1.089458
H -2.065162 0.454325 1.262572
H -1.184975 -0.162494 -1.764212
H -0.828526 -1.901000 -1.476712
H -3.788978 1.122131 -1.218659
H -2.143079 1.709600 -0.892304
H -1.564197 -2.108088 1.536126
H -2.093699 -3.235267 0.253913
H -3.309860 -2.438816 1.297385
H 1.549312 -1.381061 -1.151613
H 1.198584 0.356985 -1.448183
H 1.859319 0.828772 0.989542
H 2.247470 -0.903421 1.172348
H -4.640579 2.374967 0.823543
H -2.983886 2.946328 1.164548
H -3.828523 3.489748 -0.314412
H 4.522904 -1.141960 1.347939
H 4.611540 0.604641 1.774628
H 5.632153 -0.062674 0.454467
H 4.781989 1.447208 -1.226919
H 3.679830 2.285037 -0.075349
H 3.033411 1.530777 -1.576144


%chk=000226195-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226195

0 1
O -0.072149 -0.581965 -0.041345
N 3.609992 0.101819 -0.061690
C -2.451157 -1.115103 -0.242002
C -2.858112 0.168431 0.530797
C -1.121747 -0.943959 -1.002686
C -3.063824 1.421930 -0.349783
C -2.387512 -2.335553 0.706756
C 1.242655 -0.438445 -0.672706
C 2.218524 -0.017381 0.435722
C -3.619430 2.619520 0.451858
C 4.606416 -0.015002 1.022499
C 3.834371 1.314019 -0.876301
H -3.224533 -1.310119 -1.017585
H -3.800978 -0.041319 1.077888
H -2.084335 0.379506 1.294227
H -1.204353 -0.150852 -1.779492
H -0.850258 -1.895692 -1.514270
H -3.758033 1.180561 -1.181834
H -2.101618 1.713379 -0.814767
H -1.599121 -2.188348 1.466045
H -2.157137 -3.265038 0.152221
H -3.351301 -2.480278 1.229003
H 1.574870 -1.400403 -1.118655
H 1.189397 0.320841 -1.484935
H 1.848268 0.928607 0.904793
H 2.191090 -0.798222 1.217270
H -4.602141 2.375686 0.898361
H -2.935632 2.891517 1.278086
H -3.749989 3.512405 -0.187380
H 4.468795 -0.972987 1.554280
H 4.546576 0.811881 1.775962
H 5.624181 -0.006864 0.591854
H 4.866083 1.307035 -1.271302
H 3.691092 2.263112 -0.297666
H 3.146252 1.334184 -1.738524


