%chk=000224670.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224670

0 1
S -3.808845 -0.723793 -0.676604
O 4.712393 0.323522 -0.405955
O -0.986306 -2.599893 0.001038
O -3.037007 1.468205 0.618548
N -0.744460 -0.373210 0.578975
N -4.400861 1.815663 -1.191762
C 0.656089 -0.201005 0.315585
C 1.198285 1.079929 0.523023
C 1.479547 -1.259969 -0.125509
C 3.359657 0.254581 -0.138610
C 2.557334 1.314166 0.296848
C 2.829246 -1.035390 -0.353013
C -1.469290 -1.551867 0.385686
C -2.943366 -1.433872 0.733151
C 5.371505 1.596935 -0.214409
C -3.688485 1.039634 -0.311137
H 0.567307 1.901308 0.861691
H 1.054156 -2.258246 -0.289555
H -1.248768 0.478043 0.881272
H 2.964861 2.306140 0.461484
H 3.486466 -1.834281 -0.693242
H -3.362575 -2.451811 0.911958
H -3.124484 -0.859026 1.666548
H 5.308534 1.905113 0.832998
H 4.951243 2.348731 -0.888233
H 6.406562 1.356821 -0.491039
H -4.934726 1.439635 -1.959657
H -4.391115 2.823439 -1.100878


%chk=000224670-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224670

0 1
S -3.949599 -0.676595 -0.738108
O 4.793432 0.350892 -0.347535
O -1.016062 -2.802668 0.119717
O -2.817073 1.500432 0.547937
N -0.743037 -0.487709 0.506741
N -4.412632 1.969767 -1.080736
C 0.651014 -0.304933 0.285697
C 1.167869 1.008884 0.417108
C 1.535615 -1.368066 -0.053898
C 3.412154 0.212369 -0.122619
C 2.538491 1.275160 0.216247
C 2.900783 -1.102168 -0.254413
C -1.479626 -1.654991 0.405667
C -2.974023 -1.459887 0.696522
C 5.363389 1.691824 -0.216964
C -3.646907 1.116878 -0.326656
H 0.492781 1.833182 0.678714
H 1.140198 -2.380318 -0.154702
H -1.296757 0.363332 0.707525
H 2.904573 2.300168 0.325872
H 3.593533 -1.908020 -0.515795
H -3.437971 -2.446831 0.833532
H -3.153547 -0.820179 1.576716
H 5.230543 2.090015 0.808473
H 4.915610 2.394893 -0.947043
H 6.435727 1.571077 -0.430340
H -5.104356 1.628835 -1.746629
H -4.281223 2.974156 -0.961827


