%chk=000267492.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267492

0 1
O -4.657526 1.080869 0.020940
O -2.755085 -1.966173 -0.076337
N 5.711011 -0.225891 -0.307229
N -0.761921 -0.042977 -0.064548
N -2.099278 0.273181 -0.036191
C 4.322186 0.037985 -0.142188
C 3.854381 1.369126 -0.014255
C 3.370692 -1.005867 -0.235714
C 1.547702 0.598322 -0.088189
C 2.490619 1.637889 0.006705
C 2.009291 -0.725287 -0.212265
C 6.166196 -1.616424 -0.031946
C 6.654312 0.780940 0.252613
C 0.114404 0.926836 -0.055901
C -4.442345 -0.312698 -0.014639
C -3.037299 -0.790907 -0.046164
C -5.643493 -0.978315 -0.013074
C -6.675018 0.026629 0.025030
C -6.042533 1.243275 0.044385
H 4.558623 2.194892 0.053447
H 3.693065 -2.039647 -0.340067
H 2.154710 2.670583 0.101037
H 1.285058 -1.543208 -0.287895
H 6.047058 -1.922036 1.019353
H 5.602448 -2.322159 -0.668379
H 7.228398 -1.717221 -0.308568
H 6.617537 0.859202 1.350443
H 7.684131 0.525116 -0.046237
H 6.434252 1.774068 -0.177898
H -0.119106 2.002150 -0.025297
H -5.798177 -2.044307 -0.035797
H -2.427138 1.248478 -0.010391
H -7.730927 -0.170088 0.035370
H -6.342228 2.268469 0.072445


%chk=000267492-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267492

0 1
O -4.645749 1.134862 0.036723
O -2.952304 -2.108194 -0.172858
N 5.753243 -0.206180 -0.008166
N -0.788136 -0.260596 -0.033742
N -2.124008 0.105719 -0.015258
C 4.373935 0.015593 0.004705
C 3.835061 1.339999 0.097905
C 3.444249 -1.077238 -0.075613
C 1.528403 0.466154 0.026814
C 2.446906 1.549256 0.107631
C 2.062913 -0.853031 -0.064423
C 6.282401 -1.573418 -0.106421
C 6.680994 0.927798 0.090070
C 0.092020 0.722768 0.038122
C -4.497496 -0.277751 -0.057035
C -3.135724 -0.862000 -0.087836
C -5.753046 -0.865586 -0.105259
C -6.728969 0.198281 -0.040341
C -6.027748 1.390513 0.044593
H 4.501007 2.204599 0.162633
H 3.809926 -2.105342 -0.145747
H 2.064281 2.575990 0.179438
H 1.363379 -1.693270 -0.125770
H 5.961676 -2.202017 0.748802
H 5.956382 -2.074476 -1.040070
H 7.383207 -1.540046 -0.107126
H 6.538473 1.494039 1.033035
H 7.717491 0.556162 0.071872
H 6.558013 1.635820 -0.754783
H -0.219921 1.786813 0.109708
H -5.935205 -1.935049 -0.178532
H -2.405378 1.096977 0.051340
H -7.811655 0.091308 -0.054824
H -6.314620 2.436347 0.113012


