%chk=000230912.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230912

0 1
S -0.051666 -3.017299 1.010980
S 1.976714 -2.789624 0.857887
N -0.946825 -0.588483 0.195411
N 1.229556 -0.846962 -0.876002
N 0.108440 -0.594162 2.406068
N -1.994395 -1.723683 2.108385
N 1.556497 -3.032856 -1.874729
N 3.496891 -1.875635 -1.123241
N -0.842478 -1.268062 -2.083815
C -0.744599 -1.315891 1.474132
C 2.065680 -2.063918 -0.905568
C -0.236339 -0.953527 -0.997012
C -1.967778 0.439699 0.134009
C 1.749091 0.438042 -0.480699
C -2.998032 0.373647 -0.818309
C 1.235753 1.573703 -1.144244
C -1.917760 1.496458 1.061373
C 2.726883 0.591533 0.517043
C -3.966172 1.379792 -0.848361
C 1.712437 2.839949 -0.811943
C -2.900931 2.486246 1.022369
C 3.200615 1.870499 0.827047
C -3.923748 2.433887 0.069266
C 2.700372 2.994868 0.168915
H 0.900058 -0.123468 1.969286
H 0.431955 -1.161140 3.189182
H -2.769994 -1.842533 1.458223
H -2.283930 -1.122894 2.878957
H 0.645721 -3.430003 -1.634389
H 2.212306 -3.801459 -2.031801
H 3.934797 -1.185975 -0.515257
H 3.724144 -1.648835 -2.092672
H -3.039033 -0.451417 -1.535369
H 0.468899 1.465600 -1.910980
H -1.117094 1.547987 1.800630
H 3.114063 -0.264632 1.069366
H -0.314375 -1.444086 -2.938302
H -4.762168 1.336212 -1.591374
H 1.312931 3.716877 -1.322984
H -2.865879 3.307354 1.737628
H 3.963632 1.985243 1.597685
H -4.683857 3.211686 0.042224
H 3.070722 3.986862 0.417784


%chk=000230912-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230912

0 1
S -0.033973 -3.053289 1.123896
S 2.182811 -2.875718 0.942840
N -0.942116 -0.457904 0.158511
N 1.244369 -0.836403 -0.804847
N 0.225365 -0.350842 2.303556
N -1.873842 -1.358193 2.259142
N 1.394292 -3.001608 -1.846156
N 3.403985 -1.921505 -1.413080
N -0.789165 -1.135817 -2.121914
C -0.690929 -1.087276 1.513378
C 2.051037 -2.073538 -0.984578
C -0.198364 -0.849788 -0.984970
C -2.079610 0.433633 0.048595
C 1.848090 0.394173 -0.386987
C -3.046249 0.314130 -0.983220
C 1.289184 1.615798 -0.860839
C -2.222767 1.462716 1.020937
C 2.980063 0.452546 0.477991
C -4.128151 1.222463 -1.041643
C 1.850402 2.853518 -0.490924
C -3.317620 2.349924 0.963622
C 3.546100 1.701018 0.825353
C -4.277993 2.237034 -0.069853
C 2.991166 2.907794 0.345381
H 1.002902 0.090953 1.806279
H 0.480540 -0.805067 3.184189
H -2.575511 -1.967531 1.839935
H -2.218796 -0.609342 2.859713
H 0.416368 -3.194803 -1.591845
H 1.955536 -3.853202 -1.949837
H 4.049173 -1.394890 -0.829077
H 3.527392 -1.818431 -2.422399
H -2.920103 -0.470772 -1.731795
H 0.419375 1.587423 -1.525805
H -1.458146 1.571590 1.798205
H 3.372953 -0.463693 0.931369
H -0.094933 -1.252633 -2.885221
H -4.863811 1.123858 -1.848307
H 1.399787 3.778499 -0.867402
H -3.410969 3.139712 1.718054
H 4.416198 1.723574 1.491500
H -5.125040 2.930373 -0.116886
H 3.432106 3.871117 0.621942


