%chk=000299807.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299807

0 1
I -3.557945 -0.067674 1.787984
O -0.353507 -0.048103 0.230123
O -2.653710 -1.969053 -1.922772
O -2.569496 2.641586 -0.398029
O 1.605029 -2.760981 -0.638089
O -0.856737 2.409245 1.077916
N -0.075165 -1.262069 -0.446210
C -1.088017 -2.304231 -0.080111
C -2.486174 -1.781575 -0.514288
C -2.749679 -0.295020 -0.214463
C -1.508810 0.560384 -0.427190
C -1.045296 -2.696422 1.390202
C 1.332404 -1.598604 -0.403124
C -1.565213 1.940959 0.228399
C 2.343223 -0.517980 -0.260259
C 2.188732 0.567849 0.611233
C 3.520499 -0.647011 -1.020587
C -2.851536 3.975163 0.110546
C 3.202447 1.526611 0.712026
C 4.524727 0.315633 -0.919588
C 4.365479 1.403961 -0.052702
H -0.837321 -3.204289 -0.717717
H -3.297714 -2.428871 -0.096172
H -3.580747 0.067647 -0.869966
H -1.290551 0.671020 -1.521206
H -1.118901 -1.818118 2.051387
H -1.861553 -3.376457 1.659925
H -0.104836 -3.210009 1.634406
H -1.873645 -1.646193 -2.426670
H 1.280698 0.681983 1.216769
H 3.642583 -1.507948 -1.682574
H 3.077565 2.371576 1.388908
H 5.433556 0.218092 -1.511345
H -1.921183 4.537763 0.241309
H -3.389386 3.876245 1.059273
H -3.483226 4.400746 -0.676746
H 5.151508 2.154842 0.026304


%chk=000299807-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299807

0 1
I -3.877218 -0.238176 1.726933
O -0.427771 -0.001121 0.559606
O -2.250321 -1.727798 -2.097212
O -2.774842 2.625250 -0.344921
O 1.542986 -2.678617 -0.883612
O -1.066066 2.558477 1.249761
N -0.059795 -1.232494 -0.142060
C -1.092593 -2.295566 0.018699
C -2.396140 -1.747843 -0.626306
C -2.773078 -0.295678 -0.217996
C -1.527689 0.613651 -0.220413
C -1.190954 -2.786415 1.476873
C 1.290400 -1.511756 -0.435201
C -1.733821 2.018321 0.348623
C 2.367660 -0.470567 -0.302961
C 2.315142 0.700487 0.504342
C 3.558459 -0.753586 -1.031870
C -3.139079 3.994171 0.104583
C 3.431011 1.565381 0.562608
C 4.661573 0.119152 -0.977469
C 4.601039 1.286380 -0.178848
H -0.744059 -3.128932 -0.617158
H -3.238084 -2.427015 -0.420786
H -3.525221 0.094084 -0.919843
H -1.199391 0.717675 -1.277167
H -1.349440 -1.952128 2.177677
H -2.027593 -3.498927 1.588008
H -0.256151 -3.307585 1.746826
H -1.294876 -1.566055 -2.319139
H 1.422756 0.936274 1.085668
H 3.593998 -1.672759 -1.625390
H 3.380569 2.459740 1.193063
H 5.566710 -0.109909 -1.550357
H -2.261161 4.658588 0.047784
H -3.508617 3.956037 1.142652
H -3.929458 4.313716 -0.587595
H 5.459215 1.966239 -0.130499


