%chk=000208691.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208691

0 1
O -1.118887 -1.119610 0.933279
O 5.729080 -1.456223 0.343139
O 5.857869 0.632256 -0.204897
N 1.121029 2.238611 -0.237935
N 5.233234 -0.368612 0.103878
C 0.957526 -0.131067 0.392464
C -0.445580 0.006308 0.475772
C -1.079882 1.237054 0.228837
C 1.706243 1.040430 0.031574
C -0.232697 2.345267 -0.142339
C 1.651039 -1.365296 0.649084
C 3.149151 0.946836 -0.061470
C -2.496687 1.464869 0.348818
C 3.751468 -0.252255 0.194402
C -0.837780 3.630806 -0.420949
C 3.008387 -1.430917 0.553891
C -3.027320 2.692886 0.088428
C -2.185163 3.789725 -0.309784
C -2.172027 -1.652260 0.177155
C -2.327343 -1.444516 -1.195531
C -3.015506 -2.484941 0.926933
C -3.377732 -2.107693 -1.838857
C -4.050904 -3.135783 0.255443
C -4.235035 -2.947398 -1.120943
H 1.048711 -2.236639 0.923153
H 3.716523 1.847611 -0.334932
H -3.127050 0.631055 0.664316
H -0.172638 4.446787 -0.713459
H 3.562830 -2.355700 0.743489
H -4.098202 2.874577 0.179373
H -2.657373 4.751894 -0.515029
H -1.655222 -0.795009 -1.750824
H -2.850141 -2.614776 1.994361
H -3.523448 -1.967467 -2.910677
H -4.721868 -3.793918 0.808851
H -5.047907 -3.459393 -1.632813


%chk=000208691-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208691

0 1
O -1.229532 -1.021233 1.040996
O 5.712722 -1.574086 0.275498
O 5.859688 0.611407 -0.361035
N 1.139152 2.285714 -0.282207
N 5.185774 -0.423105 0.013323
C 0.916516 -0.093208 0.432676
C -0.487996 0.071139 0.551022
C -1.096534 1.330022 0.289070
C 1.694366 1.067103 0.007359
C -0.217717 2.418473 -0.143196
C 1.586444 -1.335838 0.707652
C 3.117355 0.931665 -0.124698
C -2.501677 1.585746 0.449961
C 3.712268 -0.293452 0.153927
C -0.800230 3.703421 -0.429645
C 2.963285 -1.444608 0.572674
C -3.021980 2.846343 0.171066
C -2.167178 3.911672 -0.280045
C -2.208896 -1.672296 0.231700
C -2.285100 -1.506403 -1.168567
C -3.075436 -2.546071 0.922607
C -3.263394 -2.234489 -1.883816
C -4.044078 -3.266391 0.191074
C -4.144412 -3.112944 -1.212643
H 0.986956 -2.190823 1.032019
H 3.707638 1.794433 -0.441649
H -3.155587 0.782810 0.801593
H -0.121360 4.495985 -0.757735
H 3.496451 -2.376055 0.775938
H -4.093062 3.034975 0.299861
H -2.600927 4.893664 -0.496983
H -1.600573 -0.831670 -1.691915
H -2.978437 -2.649898 2.007369
H -3.330140 -2.113718 -2.970483
H -4.720084 -3.947390 0.719224
H -4.897589 -3.673399 -1.775791


