%chk=000206970.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206970

0 1
O -0.342969 -0.530595 0.078883
O -3.551304 -0.635302 -1.964440
O -0.608427 0.322166 -2.018901
O 1.369240 -4.187650 0.389629
O -0.428938 -3.050348 0.015980
N 1.242580 1.772015 -0.082485
N 0.770389 -3.139647 0.189316
C 1.852103 0.526940 -0.009213
C 3.261264 0.365007 0.043730
C 1.010253 -0.651371 0.033189
C 1.582651 -1.911811 0.152698
C 3.819400 -0.946482 0.168112
C 3.006685 -2.045189 0.230156
C 4.064288 1.550038 -0.019871
C -2.359466 0.543968 -0.307815
C 3.456775 2.775527 -0.112702
C -1.083644 0.179877 -0.935675
C 2.022292 2.846063 -0.134717
C -3.599555 0.140820 -0.844871
C -2.356247 1.319848 0.866675
C -4.815474 0.521707 -0.247248
C -3.555230 1.704576 1.461822
C -4.779360 1.304181 0.904045
H 4.903307 -1.051798 0.214655
H 3.416201 -3.058617 0.334358
H 5.150511 1.453171 0.005323
H 4.033002 3.698052 -0.169318
H 1.524213 3.822742 -0.197815
H -1.394457 1.616753 1.298719
H -5.762638 0.205970 -0.673975
H -3.544033 2.310627 2.365693
H -5.714254 1.607299 1.380101
H -4.452156 -0.912935 -2.277637


%chk=000206970-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206970

0 1
O -0.265407 -0.395367 0.496666
O -3.343197 0.404492 -2.384897
O -0.677722 -0.049085 -1.790164
O 1.488733 -4.003023 1.380064
O -0.308032 -3.124635 0.282495
N 1.306055 1.791163 -0.143221
N 0.899024 -3.054869 0.722663
C 1.926562 0.559921 -0.013118
C 3.354951 0.379154 -0.144712
C 1.093651 -0.583077 0.274968
C 1.699538 -1.838638 0.445599
C 3.927598 -0.919417 0.051925
C 3.116295 -2.005804 0.357228
C 4.135983 1.538916 -0.458479
C -2.445367 0.384833 -0.125779
C 3.502235 2.772934 -0.610396
C -1.110202 -0.000794 -0.631986
C 2.081949 2.850757 -0.434082
C -3.541830 0.593602 -1.018579
C -2.665678 0.567957 1.267863
C -4.808631 0.978021 -0.510427
C -3.921797 0.951518 1.770215
C -4.997498 1.156787 0.873066
H 5.011296 -1.049453 -0.040241
H 3.526492 -3.004157 0.528550
H 5.221338 1.442111 -0.573508
H 4.067477 3.677918 -0.852570
H 1.566735 3.812967 -0.534925
H -1.824127 0.403671 1.944089
H -5.644662 1.134076 -1.204715
H -4.064981 1.088468 2.846148
H -5.982193 1.454285 1.249566
H -4.187586 0.550369 -2.882907


