%chk=000281623.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281623

0 1
O 3.577281 -0.476330 -0.819396
O -1.148107 -1.970806 0.105600
O 2.980280 0.802753 0.953394
O -2.974890 -0.969582 -0.864844
N -1.128652 0.281982 -0.212732
N -2.622751 2.888484 1.473711
C 0.205540 0.297999 0.429366
C 1.292608 -0.051757 -0.600398
C -1.754401 1.560948 -0.611296
C 2.662171 0.172743 -0.027455
C -1.872764 -0.893257 -0.359893
C -1.837047 -3.269175 0.081755
C 4.995890 -0.362650 -0.471861
C -2.239089 2.302050 0.556883
C -2.855138 -3.335743 1.197398
C 5.524500 0.990556 -0.896526
H 0.401622 1.296678 0.884784
H 0.221154 -0.444954 1.265216
H 1.179546 -1.109174 -0.936651
H 1.180055 0.548705 -1.529005
H -2.618402 1.353965 -1.307468
H -1.014527 2.181925 -1.178057
H -2.285642 -3.408208 -0.918162
H -0.974062 -3.944857 0.230015
H 5.416758 -1.201170 -1.056667
H 5.105262 -0.542193 0.612512
H -3.271497 -4.345072 1.302354
H -2.419824 -3.052156 2.164624
H -3.698818 -2.652246 1.009875
H 6.614294 1.047434 -0.786441
H 5.283289 1.209506 -1.944468
H 5.091160 1.797304 -0.285768


%chk=000281623-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281623

0 1
O 3.600187 -0.440503 -0.865598
O -1.203513 -1.979119 0.083225
O 2.923516 0.684118 1.066765
O -3.082969 -0.920475 -0.862385
N -1.193552 0.300358 -0.178336
N -2.397768 3.227263 1.362089
C 0.158258 0.321174 0.422180
C 1.253096 -0.040677 -0.605805
C -1.798527 1.557726 -0.641215
C 2.645963 0.123566 -0.019776
C -1.929233 -0.864567 -0.356638
C -1.934602 -3.282408 0.023411
C 5.032082 -0.319415 -0.438467
C -2.134505 2.479983 0.470736
C -2.788808 -3.487282 1.276130
C 5.624653 1.013675 -0.902110
H 0.341077 1.327643 0.836832
H 0.190746 -0.387442 1.264221
H 1.125620 -1.079803 -0.955128
H 1.180118 0.605103 -1.502983
H -2.723727 1.300941 -1.188948
H -1.119532 2.085513 -1.339259
H -2.551929 -3.293804 -0.891570
H -1.123562 -4.024346 -0.054108
H 5.517717 -1.181248 -0.922965
H 5.078425 -0.420785 0.660025
H -3.253108 -4.490720 1.249238
H -2.174814 -3.416090 2.190503
H -3.596023 -2.737325 1.325543
H 6.701284 1.049102 -0.652230
H 5.520756 1.133309 -1.994362
H 5.128473 1.860235 -0.398617


