%chk=000189347.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189347

0 1
S -4.000739 0.198253 -0.561115
O 2.250420 1.206300 0.216406
O 1.357471 -3.005601 -1.522018
O -5.035134 -0.868805 -0.452725
N 3.091077 -0.508756 -1.055784
C -0.929616 -0.776632 0.239558
C -2.191056 -0.955612 1.103993
C 0.025240 0.268037 0.884171
C -0.234826 -2.138934 0.039987
C -3.132192 0.249374 1.078325
C 1.320454 0.189897 0.191275
C 1.044102 -2.095956 -0.796934
C 1.812559 -0.856962 -0.574793
C -4.154515 0.185970 2.197600
C 3.344783 0.697730 -0.588303
C -4.863210 1.813770 -0.475343
C 4.495097 1.614917 -0.712329
C 5.520279 1.397428 0.414701
C -5.509446 2.051899 -1.824040
C 5.022162 1.921498 1.757033
H -1.219722 -0.395678 -0.772687
H -1.896773 -1.174128 2.151775
H -2.743943 -1.868673 0.784135
H 0.160401 0.061594 1.969489
H -0.411525 1.285907 0.829517
H -0.940995 -2.852378 -0.437610
H 0.019121 -2.597388 1.017952
H -2.555895 1.197544 1.135147
H -3.684700 0.014873 3.174355
H -4.871925 -0.639779 2.040467
H -4.740185 1.108171 2.284242
H -5.625847 1.814464 0.324808
H -4.139550 2.606918 -0.228662
H 4.982513 1.451506 -1.702208
H 4.141951 2.670030 -0.711868
H 5.762594 0.316972 0.493324
H 6.468997 1.900215 0.139835
H -4.778470 2.095011 -2.641384
H -6.233904 1.260037 -2.073576
H -6.063077 3.000764 -1.836274
H 4.915508 3.012174 1.754909
H 4.040107 1.500725 2.012071
H 5.712909 1.659605 2.566777


%chk=000189347-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189347

0 1
S -3.806768 0.218839 -0.910388
O 1.888166 1.665233 0.613217
O 1.936368 -2.948552 -0.189135
O -5.102754 -0.826988 -1.119496
N 3.156541 -0.115872 -0.122759
C -1.007411 -0.777191 0.609396
C -2.393287 -1.011451 1.259700
C -0.317572 0.512807 1.153966
C -0.108057 -2.029857 0.821325
C -3.439300 0.100817 1.072329
C 1.097799 0.512440 0.687613
C 1.314499 -1.933861 0.227763
C 1.858072 -0.564655 0.248739
C -4.779194 -0.206722 1.735155
C 3.162962 1.184545 0.095705
C -4.636927 1.997854 -0.903959
C 4.222538 2.215805 -0.126866
C 5.618235 1.600986 -0.397461
C -5.607240 2.063504 -2.081894
C 6.230623 0.901265 0.834210
H -1.140763 -0.644204 -0.483698
H -2.253061 -1.157899 2.352399
H -2.821795 -1.959328 0.875647
H -0.359391 0.522210 2.263879
H -0.835701 1.426262 0.808141
H -0.586943 -2.925739 0.387555
H 0.004550 -2.224526 1.910191
H -3.040671 1.103847 1.305498
H -4.626207 -0.709810 2.707184
H -5.356260 -0.886309 1.070417
H -5.386172 0.698562 1.907896
H -5.150300 2.084546 0.067397
H -3.795942 2.709900 -0.963649
H 3.917722 2.852832 -0.982144
H 4.260701 2.884113 0.755606
H 5.537298 0.877479 -1.229414
H 6.286287 2.416013 -0.736323
H -5.080194 2.071437 -3.052187
H -6.274000 1.181860 -2.058067
H -6.228269 2.975588 -2.016814
H 6.326414 1.599992 1.687152
H 5.607154 0.046749 1.149229
H 7.238748 0.513783 0.601142


