%chk=000288044.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288044

0 1
O 1.623407 0.526225 -1.499881
O 0.946223 3.277675 -0.026631
O 3.170084 2.478408 0.876788
O 2.414006 -1.854444 -0.498357
N -0.528228 0.042101 -0.663559
N 4.232358 -0.987825 0.577892
N -1.537123 -2.020653 -0.591118
N -2.398330 1.413342 0.301964
N -4.366164 0.055543 0.838907
N -4.456665 -2.284776 0.500475
C 0.828036 1.899335 0.326256
C 0.438338 1.121237 -0.963929
C 2.262740 1.416285 0.673967
C 2.709157 0.565354 -0.545374
C 3.069565 -0.881517 -0.173426
C -1.808269 0.249150 -0.131608
C -0.420822 -1.371731 -0.922687
C -2.426100 -1.046478 -0.095240
C -3.757542 -1.111597 0.412172
C 4.737619 -2.309140 1.003233
C -3.666893 1.229842 0.763260
H 0.108006 1.769976 1.161304
H 0.048786 1.779495 -1.782017
H 2.295535 0.848007 1.631580
H 3.538728 1.053183 -1.111394
H 0.142688 3.770606 0.266370
H 2.906380 3.281163 0.341896
H 0.508878 -1.793080 -1.318974
H 4.782418 -0.180637 0.852768
H 5.734473 -2.502983 0.573238
H 4.057857 -3.116006 0.658847
H 4.800715 -2.366532 2.102531
H -4.200284 2.127197 1.121130
H -5.400465 -2.299002 0.852452
H -4.040413 -3.148022 0.184361


%chk=000288044-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288044

0 1
O 1.553177 0.451579 -1.533363
O 1.328601 3.190510 -0.085055
O 3.007484 1.900682 1.489932
O 2.705466 -1.987348 -0.750188
N -0.612685 0.015762 -0.597337
N 4.381301 -0.882319 0.453406
N -1.616064 -2.030802 -0.354705
N -2.495443 1.488564 0.089034
N -4.495954 0.186673 0.691202
N -4.568253 -2.175744 0.617029
C 0.806681 1.869121 0.280190
C 0.361617 1.066965 -0.970411
C 2.045594 1.078114 0.779039
C 2.641885 0.484860 -0.541230
C 3.234776 -0.922024 -0.316207
C -1.915224 0.274961 -0.160032
C -0.485541 -1.386553 -0.706345
C -2.516894 -1.002805 -0.014451
C -3.870128 -1.013506 0.433927
C 5.102375 -2.096098 0.858270
C -3.790948 1.344021 0.509270
H -0.003969 1.949338 1.023710
H -0.095168 1.716509 -1.737509
H 1.739196 0.278359 1.472211
H 3.423086 1.172820 -0.917246
H 0.587166 3.835456 -0.185373
H 2.919371 2.818258 1.105007
H 0.453064 -1.842927 -1.023369
H 4.674236 0.023462 0.833628
H 6.151935 -2.066437 0.513887
H 4.596530 -2.956963 0.393155
H 5.088117 -2.223268 1.956307
H -4.333145 2.268646 0.729287
H -5.533727 -2.128772 0.935723
H -4.119817 -3.069393 0.425803


