%chk=000198072.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198072

0 1
O 2.270339 1.400715 0.488383
O -2.045502 -2.469839 -0.281395
N -0.263021 1.138145 0.066142
N -0.108478 -1.244088 -0.129038
C 2.004450 0.061570 0.003002
C 0.461478 -0.078344 -0.016135
C 2.529195 0.045061 -1.425377
C 2.632040 -0.980743 0.911604
C -1.671692 1.095105 0.021797
C -2.296953 -0.106335 -0.094941
C -1.553070 -1.370417 -0.178781
C -2.368797 2.409305 0.109512
H 3.624481 0.112721 -1.447013
H 2.148696 0.896980 -2.004273
H 2.237264 -0.878271 -1.947090
H 2.386462 -2.000352 0.558307
H 2.256303 -0.929239 1.940363
H 3.724638 -0.900498 0.934734
H 0.246498 2.022651 0.153838
H 2.557318 1.397752 1.421746
H -3.380085 -0.194579 -0.133790
H -2.146605 2.936208 1.050018
H -3.464564 2.291117 0.069122
H -2.097294 3.079177 -0.721034


%chk=000198072-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198072

0 1
O 2.178598 1.534771 0.359676
O -2.055378 -2.442156 -0.817275
N -0.300828 1.109906 0.148243
N -0.086557 -1.206969 -0.424596
C 1.961568 0.107420 -0.014913
C 0.434928 -0.037221 -0.109418
C 2.601211 -0.187137 -1.388053
C 2.508712 -0.823356 1.088013
C -1.697620 1.084883 0.085026
C -2.303533 -0.110800 -0.240651
C -1.522330 -1.334204 -0.516255
C -2.416302 2.376779 0.383722
H 3.704365 -0.137975 -1.319584
H 2.258056 0.543488 -2.140944
H 2.310095 -1.197027 -1.721310
H 2.210353 -1.862834 0.873881
H 2.102467 -0.536849 2.073595
H 3.612935 -0.769023 1.127659
H 0.241073 1.951767 0.377869
H 3.147610 1.705843 0.441212
H -3.392234 -0.181178 -0.303110
H -2.202911 2.725293 1.412076
H -3.504406 2.241150 0.287385
H -2.106771 3.179233 -0.312547


