%chk=000095865.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000095865

0 1
O -0.546183 -2.534305 0.491207
O 6.064708 -0.665642 -0.476325
N 4.717847 1.118046 0.103738
C 0.891612 -0.681079 0.209540
C 3.447398 0.469385 0.132328
C 1.057491 0.684972 0.480177
C 2.019834 -1.467616 -0.083314
C 2.321930 1.266422 0.445952
C 3.291224 -0.903208 -0.132158
C -0.442099 -1.344875 0.253789
C -4.085069 -0.112084 0.117609
C -1.633589 -0.498338 -0.024723
C -2.856136 -0.881166 0.369194
C -4.099672 1.289559 0.204597
C -5.268756 -0.799216 -0.205987
C 5.964992 0.509483 -0.199177
C -5.283179 1.993964 -0.032934
C -6.445598 -0.088939 -0.450494
C -6.455571 1.307681 -0.363130
C 7.124779 1.463195 -0.140847
H 0.193025 1.302177 0.731549
H 1.887917 -2.538816 -0.271028
H 2.432665 2.325276 0.662226
H 4.161034 -1.526729 -0.370041
H -1.458499 0.415809 -0.589582
H 4.709499 2.116129 0.326339
H -2.994148 -1.829890 0.909056
H -3.190191 1.827864 0.465608
H -5.265825 -1.886745 -0.274175
H -5.290716 3.080497 0.038926
H -7.358599 -0.624214 -0.707975
H -7.375680 1.858363 -0.550878
H 7.033782 2.286098 -0.862288
H 8.058632 0.927469 -0.387478
H 7.265640 1.897772 0.857900


%chk=000095865-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095865

0 1
O -0.575650 -2.424758 -0.092232
O 6.285850 -0.858048 0.038325
N 4.894550 1.036460 0.078152
C 0.922870 -0.542420 -0.007356
C 3.596858 0.462485 0.049074
C 1.172582 0.857333 0.035469
C 2.043645 -1.417992 -0.021038
C 2.486834 1.352543 0.062944
C 3.363984 -0.941791 0.006599
C -0.448239 -1.153764 -0.040717
C -4.189097 -0.099892 -0.026463
C -1.645161 -0.270592 -0.012541
C -2.904588 -0.809674 -0.048058
C -4.300744 1.320682 0.046697
C -5.389601 -0.867004 -0.080381
C 6.143792 0.396335 0.072171
C -5.562968 1.943538 0.064432
C -6.654354 -0.243847 -0.063044
C -6.746471 1.165338 0.009579
C 7.325008 1.366050 0.112856
H 0.348507 1.576754 0.046163
H 1.843057 -2.493919 -0.054611
H 2.657210 2.436646 0.095013
H 4.214450 -1.624833 -0.004137
H -1.502291 0.813356 0.037887
H 4.919241 2.059186 0.106678
H -2.948711 -1.908221 -0.098780
H -3.396561 1.937844 0.090477
H -5.318874 -1.960101 -0.136118
H -5.631574 3.035641 0.121078
H -7.564256 -0.852242 -0.105482
H -7.726868 1.654120 0.023651
H 7.309028 2.058260 -0.749493
H 8.256654 0.783726 0.081124
H 7.316389 1.970098 1.039286


