%chk=000230172.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230172

0 1
O 1.289627 -1.543477 -0.924629
N 2.539896 -0.414303 0.609079
C -2.403993 0.218395 0.428030
C -3.680206 -0.240171 -0.290903
C -1.165962 -0.480613 -0.144111
C -4.924699 0.454888 0.276683
C 0.115360 -0.028147 0.568035
C -6.201123 -0.004554 -0.442166
C 1.326763 -0.732144 -0.014794
C 3.822759 -0.952628 0.095575
C 4.695267 0.137196 -0.544093
C 5.366174 1.047550 0.492357
C -7.444089 0.683494 0.117813
C 6.259103 2.093093 -0.171747
H -2.489970 0.011401 1.512179
H -2.296695 1.316406 0.336808
H -3.595412 -0.034928 -1.375852
H -3.788175 -1.338765 -0.201778
H -1.075068 -0.284229 -1.232127
H -1.266883 -1.582350 -0.060835
H -5.011385 0.249510 1.360877
H -4.819078 1.552986 0.186415
H 0.038045 -0.239894 1.653986
H 0.230966 1.070268 0.475764
H -6.309327 -1.103217 -0.351394
H -6.116806 0.201488 -1.527250
H 3.599373 -1.748828 -0.658683
H 4.358022 -1.448157 0.935429
H 5.469556 -0.348062 -1.171638
H 4.089455 0.742107 -1.247734
H 2.609006 0.327256 1.293855
H 5.966440 0.437891 1.196564
H 4.598071 1.553609 1.108114
H -7.386580 1.772383 0.008682
H -8.349120 0.349280 -0.401732
H -7.579349 0.467719 1.183680
H 5.690836 2.737515 -0.852486
H 6.733647 2.741150 0.573728
H 7.060456 1.627582 -0.757400


%chk=000230172-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230172

0 1
O 1.400491 -0.761133 -1.772581
N 2.493868 -0.384305 0.248580
C -2.404123 0.443902 0.113918
C -3.717036 -0.328040 -0.148458
C -1.144719 -0.357599 -0.280731
C -4.984418 0.478953 0.213188
C 0.166522 0.413092 0.000947
C -6.297138 -0.295635 -0.044514
C 1.391459 -0.295120 -0.591161
C 3.771000 -0.982484 -0.179129
C 4.875346 0.062347 -0.467274
C 5.300023 0.886845 0.769288
C -7.559119 0.521213 0.308420
C 6.431483 1.889867 0.455860
H -2.352198 0.722064 1.188014
H -2.421630 1.398019 -0.454015
H -3.760521 -0.619123 -1.218623
H -3.707790 -1.275339 0.430362
H -1.171204 -0.605106 -1.358552
H -1.129697 -1.323090 0.264207
H -4.939885 0.776077 1.282292
H -4.997435 1.423125 -0.370879
H 0.289480 0.585098 1.089060
H 0.100329 1.411265 -0.478153
H -6.286698 -1.235794 0.544113
H -6.337147 -0.598038 -1.110952
H 3.547220 -1.558122 -1.094152
H 4.116433 -1.690073 0.601041
H 5.759815 -0.474485 -0.867537
H 4.524787 0.741316 -1.268949
H 2.425736 0.011538 1.187079
H 5.627680 0.197007 1.574741
H 4.423455 1.441598 1.162650
H -7.610145 1.449585 -0.291435
H -8.482834 -0.055632 0.117362
H -7.557151 0.812427 1.376036
H 6.118851 2.603819 -0.328984
H 6.717107 2.472836 1.350595
H 7.334706 1.365825 0.090627


