%chk=000208327.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208327

0 1
I -3.120031 -2.867246 -0.562457
O 0.064506 2.318652 0.302205
O 0.022633 -2.247576 -0.373832
N 0.099657 0.010834 -0.031554
N -1.968821 1.260020 0.146241
C -2.727005 0.098700 -0.050453
C -0.520963 1.265670 0.150327
C 1.563408 -0.019447 -0.017066
C -0.632841 -1.244630 -0.238063
C -2.077819 -1.091543 -0.240446
C -2.626298 2.576216 0.363382
C -4.207986 0.253584 -0.038865
C 2.219046 -0.951219 0.802558
C 2.284822 0.874076 -0.823989
C 3.615616 -0.983654 0.805131
C 3.680760 0.828908 -0.801563
C 4.346939 -0.096556 0.008514
H -1.857295 3.368883 0.497510
H -3.247846 2.560529 1.273528
H -3.243391 2.856682 -0.505691
H -4.577295 0.664802 0.913481
H -4.734158 -0.713913 -0.177245
H -4.562391 0.909097 -0.849869
H 1.648794 -1.657218 1.407095
H 1.767504 1.605759 -1.443769
H 4.134583 -1.708013 1.432168
H 4.250666 1.520773 -1.420724
H 5.434805 -0.127270 0.018045


%chk=000208327-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208327

0 1
I -3.099529 -2.909912 -0.792090
O 0.108273 2.314276 0.481328
O 0.035881 -2.268421 -0.554704
N 0.079271 0.023055 -0.038741
N -1.966194 1.253337 0.201184
C -2.726027 0.103131 -0.082955
C -0.539946 1.263077 0.230294
C 1.540717 -0.009705 -0.022344
C -0.611984 -1.212635 -0.331640
C -2.074787 -1.092125 -0.343541
C -2.624728 2.548901 0.493392
C -4.225322 0.277252 -0.081280
C 2.204095 -0.808043 0.932828
C 2.266875 0.745232 -0.967431
C 3.615113 -0.847895 0.941714
C 3.677784 0.704851 -0.949239
C 4.354319 -0.091381 0.003434
H -1.826543 3.278309 0.692544
H -3.272927 2.468707 1.382179
H -3.221774 2.891303 -0.368651
H -4.587268 0.626751 0.902822
H -4.724077 -0.674556 -0.309765
H -4.541704 1.020230 -0.836363
H 1.624127 -1.401440 1.645731
H 1.736207 1.364059 -1.697244
H 4.134449 -1.470334 1.678087
H 4.245980 1.292629 -1.678057
H 5.449318 -0.123754 0.013107


