%chk=000202712.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202712

0 1
O 0.647016 1.171419 1.297304
O 3.231209 0.676258 -0.054433
N 1.085600 -0.151392 -0.524263
N 3.033882 -1.515349 -0.705892
C -1.159942 0.965699 -0.342613
C -1.874162 -0.359720 -0.689620
C -1.933161 -1.353882 0.477550
C -1.961301 1.756652 0.698839
C -0.973497 1.813791 -1.609503
C 0.250080 0.712424 0.254930
C -2.662527 -2.635736 0.084226
C 2.512421 -0.247562 -0.358407
H -2.906043 -0.124307 -1.023012
H -1.395602 -0.836704 -1.566019
H -0.912519 -1.598533 0.831963
H -2.442670 -0.885611 1.344917
H -2.091150 1.187776 1.628717
H -2.954924 2.022773 0.326002
H -1.446208 2.686865 0.978380
H -0.428758 2.743305 -1.392408
H -0.415739 1.290347 -2.392738
H -1.941093 2.105227 -2.035183
H -2.702832 -3.339310 0.924585
H -2.169049 -3.149104 -0.748119
H -3.696767 -2.436598 -0.220562
H 0.659719 -0.691381 -1.282053
H 2.472879 -2.347748 -0.625878
H 4.019841 -1.660302 -0.518512


%chk=000202712-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202712

0 1
O 0.673805 1.343777 1.354094
O 3.306644 0.517054 0.267647
N 1.114097 -0.101297 -0.438071
N 2.941375 -1.522233 -0.802189
C -1.126791 0.988157 -0.317008
C -1.824834 -0.372916 -0.649878
C -1.968937 -1.364507 0.527903
C -1.978339 1.804343 0.684555
C -0.956263 1.807897 -1.632533
C 0.288534 0.778280 0.303397
C -2.633191 -2.690355 0.097456
C 2.522103 -0.304122 -0.261060
H -2.831927 -0.134485 -1.049269
H -1.298644 -0.881756 -1.489574
H -0.972833 -1.572040 0.967709
H -2.569801 -0.899110 1.331904
H -2.053972 1.299746 1.661950
H -2.996013 1.952934 0.278217
H -1.520948 2.790597 0.868947
H -0.448281 2.768420 -1.434449
H -0.366524 1.261498 -2.392413
H -1.949549 2.027300 -2.066605
H -2.736664 -3.383045 0.952197
H -2.038650 -3.204107 -0.682638
H -3.643491 -2.512838 -0.317161
H 0.669993 -0.599426 -1.213244
H 2.302190 -2.287011 -1.012120
H 3.941614 -1.711458 -0.779566


