%chk=000185757.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185757

0 1
O 7.313238 -0.891312 0.057779
O -0.575063 2.144364 -0.105930
O -4.576234 -2.909638 0.219914
O -2.376314 -2.562523 0.191420
N -1.521987 0.037531 0.027638
C -2.892793 0.379259 0.010883
C -3.869452 -0.655293 0.078063
C -3.324523 1.725656 -0.071081
C 3.382602 0.447192 -0.012992
C -5.241281 -0.310951 0.061125
C -4.675552 2.029233 -0.085541
C -5.645946 1.010560 -0.019383
C 2.025302 0.989197 -0.042398
C -0.419187 0.939612 -0.031725
C 3.635582 -0.934060 0.072142
C 4.474683 1.344475 -0.072286
C 0.895221 0.260668 0.006264
C 4.940464 -1.425841 0.098589
C 5.782761 0.881425 -0.047640
C 5.998921 -0.507497 0.038084
C -3.491625 -2.063223 0.164049
H -2.579324 2.530943 -0.123339
H -1.302686 -0.981688 0.090030
H -5.981797 -1.116467 0.113342
H -4.995260 3.071786 -0.149047
H -6.702756 1.266534 -0.031852
H 1.953666 2.087847 -0.110279
H 2.800333 -1.636957 0.118538
H 4.287917 2.418864 -0.138535
H 0.901984 -0.826753 0.073644
H 5.125981 -2.493243 0.164411
H 6.635397 1.556810 -0.092370
H 7.418916 -1.874312 0.118606
H -4.295686 -3.864897 0.278178


%chk=000185757-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185757

0 1
O 7.425471 -0.911153 0.064636
O -0.543714 2.239233 -0.116121
O -4.532492 -2.951771 0.229990
O -2.277000 -2.466380 0.181077
N -1.560895 0.106890 0.015908
C -2.926656 0.432591 0.003695
C -3.900889 -0.632961 0.076256
C -3.390097 1.778682 -0.076937
C 3.386750 0.403736 -0.011603
C -5.289210 -0.318834 0.065489
C -4.768718 2.052857 -0.085146
C -5.729102 1.011100 -0.014484
C 2.024999 0.940782 -0.041997
C -0.450268 0.971927 -0.040356
C 3.681839 -0.988812 0.071571
C 4.485742 1.312988 -0.066800
C 0.844786 0.247068 -0.000814
C 5.008323 -1.451676 0.098387
C 5.817087 0.866046 -0.041038
C 6.079536 -0.521404 0.041924
C -3.475960 -2.039366 0.162878
H -2.649205 2.577916 -0.130770
H -1.378423 -0.912006 0.077683
H -6.004772 -1.143283 0.121534
H -5.099754 3.095664 -0.147714
H -6.799272 1.239724 -0.021995
H 1.926981 2.034996 -0.104939
H 2.866674 -1.718770 0.116376
H 4.282427 2.388409 -0.130969
H 0.817915 -0.848445 0.062035
H 5.213983 -2.528082 0.163088
H 6.658188 1.563572 -0.083330
H 7.512802 -1.895107 0.124800
H -4.151574 -3.868827 0.285985


