%chk=000125777.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000125777

0 1
O 4.149657 -0.649582 0.867843
O -2.384540 0.857781 1.651605
O -3.663883 0.602092 -0.173091
N 1.336387 0.099422 -0.077955
N 1.312827 2.305879 -0.585369
N -2.524201 -2.225614 0.047896
C -0.924228 -0.664255 -1.000569
C 0.110951 0.357089 -0.726919
C -1.782543 -0.963239 0.249545
C 1.796051 -1.190876 0.457634
C 0.123710 1.724922 -1.025837
C 2.038692 1.320582 -0.014139
C 3.266713 -1.461404 0.091020
C -2.724786 0.227329 0.485531
H -1.572053 -0.326682 -1.842534
H -0.466596 -1.614720 -1.360472
H -1.119469 -1.079638 1.151968
H 1.673270 -1.189282 1.567395
H 1.149471 -2.013272 0.068098
H -0.631702 2.308553 -1.522029
H 3.026160 1.407978 0.423979
H 3.519538 -2.527941 0.228499
H 3.505102 -1.153815 -0.948986
H -3.160201 -2.167023 -0.745660
H -3.072292 -2.472286 0.867860
H 4.129239 -0.910893 1.811178
H -2.931674 1.670195 1.835210


%chk=000125777-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125777

0 1
O 4.054792 -0.459884 1.144864
O -1.771563 0.596765 1.899690
O -3.422698 0.757058 0.266915
N 1.296020 0.135199 -0.197048
N 1.268203 2.316323 -0.830430
N -2.783734 -2.138254 -0.197956
C -0.963670 -0.725340 -1.095771
C 0.075045 0.336977 -0.881213
C -1.795232 -1.115692 0.171506
C 1.731844 -1.121581 0.434649
C 0.091743 1.683304 -1.260271
C 1.970546 1.360882 -0.189766
C 3.246983 -1.377611 0.329671
C -2.433061 0.161184 0.746664
H -1.672642 -0.356681 -1.860291
H -0.537247 -1.669944 -1.485152
H -1.123523 -1.532780 0.940622
H 1.424853 -1.134592 1.501653
H 1.207144 -1.955525 -0.067793
H -0.671001 2.226854 -1.814626
H 2.947403 1.479154 0.271060
H 3.447211 -2.433011 0.610725
H 3.592426 -1.213703 -0.703619
H -3.482490 -1.791428 -0.866357
H -3.229007 -2.599072 0.602745
H 3.868830 -0.620140 2.104698
H -2.157574 1.462838 2.206533


