%chk=000281628.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281628

0 1
O 0.350947 1.586167 -1.631047
O -1.360751 -0.402151 2.542877
N 2.021338 1.024499 -0.153096
N -0.551496 -0.776239 1.469953
C 2.109432 -0.402025 -0.336756
C 4.266378 0.323280 0.473140
C 3.265258 1.498779 0.554957
C 3.432371 -0.830345 -0.008028
C 1.130168 -1.341740 -0.677736
C 3.808021 -2.156306 -0.108099
C -0.312748 -1.019575 -0.924293
C 1.537346 -2.693318 -0.776437
C 1.145167 1.931071 -0.770274
C 2.842468 -3.094233 -0.515912
C -1.102194 -0.614220 0.300482
C 1.222876 3.355837 -0.292544
C -2.471234 -0.095856 0.029672
C -3.576301 -0.691306 0.657526
C -2.660447 0.982445 -0.846740
C -4.864460 -0.218097 0.395630
C -3.950900 1.454197 -1.099989
C -5.053371 0.853353 -0.483577
H 4.725187 0.111248 1.455677
H 5.096024 0.536792 -0.225993
H 3.008739 1.739323 1.607916
H 3.670682 2.410769 0.076640
H 4.819504 -2.474075 0.129280
H -0.837282 -1.883687 -1.391805
H -0.382183 -0.199279 -1.692825
H 0.794868 -3.442761 -1.052597
H 3.119452 -4.142449 -0.609145
H 1.162983 3.438724 0.800941
H 0.373974 3.927772 -0.704905
H 2.137318 3.860521 -0.628966
H -3.423206 -1.512315 1.358208
H -1.796910 1.454637 -1.329132
H -5.720991 -0.682117 0.880764
H -4.096173 2.291253 -1.780497
H -6.057468 1.220800 -0.685718
H -0.759287 -0.584971 3.336847


%chk=000281628-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281628

0 1
O 0.478365 1.633906 -1.712748
O -1.298231 -0.202654 2.554706
N 2.050514 1.002753 -0.098091
N -0.476751 -0.665879 1.416238
C 2.150159 -0.415101 -0.357641
C 4.289791 0.344408 0.456895
C 3.189975 1.386282 0.797750
C 3.470718 -0.838428 -0.039796
C 1.151141 -1.348872 -0.743101
C 3.860958 -2.177244 -0.183435
C -0.313478 -1.023488 -0.965850
C 1.580025 -2.696208 -0.897582
C 1.227349 1.931865 -0.727769
C 2.902775 -3.114133 -0.640087
C -1.100886 -0.546732 0.259331
C 1.270025 3.360166 -0.185985
C -2.494144 -0.057491 0.022618
C -3.576004 -0.487663 0.840409
C -2.762383 0.822530 -1.063107
C -4.893303 -0.065931 0.564181
C -4.080665 1.255597 -1.323714
C -5.152443 0.808211 -0.517565
H 4.912930 0.098918 1.333271
H 4.959450 0.723974 -0.339949
H 2.874337 1.290185 1.854675
H 3.508040 2.422360 0.611448
H 4.882370 -2.490835 0.059197
H -0.833877 -1.920156 -1.356162
H -0.393944 -0.237400 -1.737441
H 0.834060 -3.440692 -1.200379
H 3.176061 -4.167256 -0.765176
H 1.293675 3.397391 0.916657
H 0.369133 3.877722 -0.547890
H 2.151904 3.906176 -0.571622
H -3.377044 -1.148930 1.687612
H -1.936522 1.195372 -1.678874
H -5.717590 -0.414061 1.197008
H -4.268927 1.942668 -2.156358
H -6.176168 1.139238 -0.726350
H -0.668295 -0.336165 3.309077


