%chk=000180700.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180700

0 1
O -0.995785 -3.032113 -0.275665
O -3.332486 -2.710399 -0.062228
O 5.203960 -1.118041 0.085910
N -0.652736 3.167664 0.025099
C -0.961432 0.683168 0.107419
C -0.079137 1.856443 0.131983
C -2.361148 0.833039 0.290412
C -0.372540 -0.608337 -0.041062
C -2.882741 2.203960 0.600632
C -2.127454 3.245297 -0.226217
C 1.274971 1.689433 0.351601
C 1.066753 -0.761217 -0.063182
C 1.880379 0.376234 0.198784
C -1.282123 -1.672378 -0.106295
C -3.247192 -0.248817 0.241686
C -2.671538 -1.493416 0.024551
C 0.071704 4.091840 -0.904908
C 2.166699 2.820553 0.761153
C 1.669565 -2.021448 -0.301718
C 3.284686 0.209721 0.248182
C -2.285789 -3.720242 -0.252758
C 3.831754 -1.046102 0.021743
C 3.042069 -2.182758 -0.265115
H -3.971073 2.288945 0.413975
H -2.745740 2.401517 1.689052
H -2.375059 3.115081 -1.304614
H -2.447883 4.270634 0.068750
H -4.317824 -0.135062 0.374948
H 0.852826 3.585050 -1.495130
H 0.553280 4.876385 -0.295259
H -0.599983 4.589483 -1.620135
H 1.602309 3.645060 1.220259
H 2.887685 2.492194 1.526003
H 2.741174 3.221995 -0.082712
H 1.035340 -2.887941 -0.521022
H 3.947157 1.047790 0.453493
H -2.300427 -4.387184 0.619030
H -2.441499 -4.183684 -1.235465
H 3.499448 -3.147901 -0.447660
H 5.536029 -2.032847 -0.081523


%chk=000180700-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180700

0 1
O -1.035183 -3.097181 -0.265405
O -3.395878 -2.747385 -0.045314
O 5.296570 -1.121554 0.087140
N -0.663564 3.131336 -0.105976
C -0.970169 0.678214 0.076180
C -0.088308 1.854766 0.094209
C -2.380370 0.846817 0.266023
C -0.383117 -0.639615 -0.062508
C -2.874703 2.235966 0.615429
C -2.130263 3.282821 -0.217999
C 1.294215 1.688939 0.310937
C 1.064420 -0.795138 -0.096634
C 1.884925 0.369120 0.160585
C -1.315863 -1.704600 -0.113743
C -3.263886 -0.251493 0.233606
C -2.695903 -1.514254 0.018468
C 0.057921 4.168942 -0.871689
C 2.185850 2.837560 0.760131
C 1.697417 -2.055049 -0.310421
C 3.303079 0.201023 0.224881
C -2.352904 -3.783706 -0.235594
C 3.890363 -1.052703 0.017194
C 3.090994 -2.195788 -0.261204
H -3.961359 2.329998 0.441986
H -2.695395 2.435794 1.691659
H -2.437201 3.192500 -1.286569
H -2.399381 4.304401 0.115263
H -4.339132 -0.129801 0.387309
H 1.003427 3.770775 -1.267178
H 0.276590 5.069546 -0.265665
H -0.562200 4.483113 -1.736723
H 1.586460 3.687703 1.121222
H 2.818592 2.503739 1.603948
H 2.874130 3.212223 -0.024315
H 1.080184 -2.933247 -0.507225
H 3.964119 1.049898 0.411200
H -2.375055 -4.481340 0.619969
H -2.515514 -4.288838 -1.204170
H 3.556014 -3.175684 -0.429568
H 5.606279 -2.046219 -0.077443


