%chk=000259399.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259399

0 1
O 4.999427 1.129679 0.519789
O -4.602587 1.689801 0.591407
N 0.066352 -2.668603 -0.607001
N -1.073510 -3.373611 -0.918860
C 1.321453 -0.706681 -0.092966
C -1.205402 -0.588449 -0.104878
C 0.025839 -1.398943 -0.292797
C 1.457953 0.639979 -0.460164
C -2.103286 -0.409069 -1.164072
C 2.425187 -1.393621 0.455330
C -1.465977 0.005612 1.145971
C 3.746980 0.611649 0.273559
C -3.509127 0.923313 0.259851
C 2.669341 1.313416 -0.279882
C -3.265998 0.348917 -0.993487
C 3.637908 -0.744672 0.646072
C -2.615452 0.758478 1.341215
C 5.241627 2.512586 0.166895
C -5.591793 1.942098 -0.435904
H 0.610076 1.173512 -0.894057
H -1.893586 -0.865234 -2.134890
H 2.324072 -2.447208 0.725575
H -0.754408 -0.128221 1.963066
H 2.756509 2.354092 -0.570264
H -3.951244 0.480614 -1.823434
H 4.500091 -1.255697 1.067666
H -2.841094 1.224498 2.297674
H 4.588658 3.172401 0.745021
H 5.118935 2.657088 -0.910281
H 6.291081 2.639096 0.463368
H -5.144595 2.495009 -1.266854
H -6.319963 2.562917 0.102782
H -6.045377 1.003231 -0.765712
H -0.892145 -4.373578 -0.807698
H -1.940946 -3.110404 -0.446043


%chk=000259399-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259399

0 1
O 5.237905 1.045403 0.284930
O -4.770802 1.737778 0.460142
N 0.036997 -2.667415 -0.410479
N -1.148251 -3.349061 -0.507066
C 1.368468 -0.699728 -0.058398
C -1.218165 -0.542706 -0.055083
C 0.041073 -1.352841 -0.188399
C 1.506486 0.712635 -0.099018
C -2.165560 -0.477249 -1.109452
C 2.556351 -1.478030 0.099303
C -1.507754 0.169037 1.144656
C 3.930127 0.543092 0.164087
C -3.624840 0.966194 0.217234
C 2.769509 1.337790 0.011186
C -3.360679 0.269037 -0.987922
C 3.815051 -0.871721 0.206491
C -2.692230 0.912375 1.284948
C 5.405403 2.498333 0.242285
C -5.760016 1.841163 -0.615670
H 0.617654 1.338631 -0.231447
H -1.955796 -0.997887 -2.051056
H 2.462174 -2.567319 0.130198
H -0.791009 0.133737 1.972455
H 2.831376 2.429658 -0.029050
H -4.059846 0.305198 -1.828838
H 4.725632 -1.466685 0.328954
H -2.917670 1.458984 2.205768
H 4.862320 2.992452 1.071965
H 5.060562 2.916146 -0.724112
H 6.486542 2.667940 0.354456
H -5.324641 2.310513 -1.519366
H -6.556745 2.482711 -0.211847
H -6.176858 0.848892 -0.877080
H -1.060980 -4.357856 -0.566728
H -2.056787 -2.915207 -0.312049


