%chk=000230321.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230321

0 1
O 1.993220 0.152193 -0.341454
O 2.619464 -0.761864 1.684743
N 4.176769 0.286075 0.293108
C -3.703919 -0.088433 -0.020047
C -2.175765 -0.018749 -0.070307
C -4.236540 0.539287 1.283918
C -4.103717 -1.576136 -0.083258
C -4.340961 0.667460 -1.203156
C -1.420986 -0.160681 1.105133
C -1.497452 0.133978 -1.291995
C -0.024388 -0.126912 1.085393
C -0.104732 0.169050 -1.346307
C 0.609061 0.043359 -0.145300
C 2.913459 -0.203809 0.651521
C 5.334376 -0.375810 0.947614
C 4.413060 0.745603 -1.096318
H -5.331172 0.551295 1.299535
H -3.909651 -0.015325 2.169883
H -3.893409 1.573673 1.394358
H -3.679532 -2.140055 0.754431
H -5.190246 -1.699842 -0.048884
H -3.744627 -2.046638 -1.004663
H -5.433762 0.661372 -1.132269
H -4.019504 1.714343 -1.224581
H -4.080637 0.216360 -2.166221
H -1.924530 -0.303737 2.062947
H -2.058999 0.223130 -2.222880
H 0.551363 -0.246221 2.006321
H 0.425477 0.290241 -2.286796
H 5.052422 -0.716916 1.963557
H 6.149250 0.360110 1.055668
H 5.708627 -1.245028 0.384214
H 5.304815 1.393788 -1.117810
H 3.548358 1.347072 -1.440409
H 4.556005 -0.083431 -1.807692


%chk=000230321-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230321

0 1
O 2.031708 0.215891 -0.333825
O 2.728528 -0.938418 1.623017
N 4.266676 0.020044 0.135819
C -3.773007 -0.091319 -0.020429
C -2.229259 -0.017726 -0.095764
C -4.277424 0.782167 1.167793
C -4.208352 -1.570728 0.208103
C -4.450193 0.418591 -1.318382
C -1.441707 -0.429618 1.012459
C -1.535076 0.447080 -1.242766
C -0.031263 -0.390340 1.003779
C -0.125663 0.496957 -1.280114
C 0.622061 0.078623 -0.159768
C 2.994931 -0.294044 0.574388
C 5.413800 -0.432367 0.938320
C 4.572726 0.773646 -1.089341
H -5.380277 0.730208 1.240057
H -3.858348 0.441396 2.131346
H -3.987995 1.839928 1.028734
H -3.785966 -1.981016 1.142851
H -5.310761 -1.640239 0.274082
H -3.869299 -2.212604 -0.625614
H -5.548691 0.352094 -1.213986
H -4.197419 1.475414 -1.524161
H -4.160731 -0.187252 -2.197015
H -1.933376 -0.796035 1.921328
H -2.088938 0.777629 -2.126221
H 0.548259 -0.724602 1.864535
H 0.403397 0.857194 -2.168000
H 5.041765 -0.982157 1.815118
H 6.013342 0.433832 1.278792
H 6.064992 -1.098719 0.340374
H 5.158590 1.680534 -0.842435
H 3.642726 1.072850 -1.587530
H 5.171439 0.151911 -1.783547


