%chk=000257552.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257552

0 1
S -2.440836 0.102127 0.725221
O -2.812616 -1.137043 1.369217
O -2.706691 1.390736 1.323151
O 1.114354 -3.624479 0.033621
O 1.412549 3.491306 -0.092639
O 3.187244 -2.791627 -0.134355
O 3.408023 2.482384 -0.230061
N -3.168284 0.104320 -0.831102
C -0.714723 0.024205 0.416609
C 0.019802 1.203253 0.293244
C -0.081498 -1.215736 0.336656
C 1.403026 1.141869 0.048009
C 1.301670 -1.278997 0.091440
C 2.049729 -0.099911 -0.049525
C -2.969020 1.328128 -1.639048
C -3.069646 -1.159172 -1.595309
C 2.005184 -2.573945 -0.012405
C 2.212184 2.368906 -0.101128
H -0.468454 2.186831 0.395204
H -0.650051 -2.150799 0.473046
H 3.134651 -0.148590 -0.231882
H -3.171220 2.220705 -1.013699
H -3.709258 1.352039 -2.460124
H -1.966937 1.418118 -2.086711
H -3.346171 -2.009435 -0.940114
H -2.077674 -1.347349 -2.034930
H -3.807768 -1.150650 -2.418532
H 1.570968 -4.509912 -0.017949
H 1.941562 4.333019 -0.175206


%chk=000257552-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257552

0 1
S -2.509957 0.112404 0.714890
O -2.914906 -1.289360 1.428933
O -2.793562 1.576550 1.358607
O 1.231323 -3.688211 0.135454
O 1.545895 3.554665 0.034167
O 3.329675 -2.729651 -0.159970
O 3.552498 2.410332 -0.236547
N -3.419252 0.110124 -0.941393
C -0.629785 0.025395 0.392166
C 0.077497 1.230775 0.280755
C -0.029886 -1.239617 0.317905
C 1.477651 1.157831 0.062568
C 1.370964 -1.294537 0.098821
C 2.118482 -0.100140 -0.029780
C -3.126747 1.335754 -1.718289
C -3.234591 -1.173426 -1.655261
C 2.096622 -2.596256 0.009723
C 2.313039 2.388910 -0.062534
H -0.424559 2.196826 0.390341
H -0.612746 -2.155275 0.455766
H 3.200539 -0.149653 -0.190989
H -3.186645 2.208694 -1.047426
H -3.922727 1.437257 -2.477980
H -2.142268 1.320316 -2.238195
H -3.370192 -2.003242 -0.942105
H -2.252643 -1.269600 -2.171305
H -4.036455 -1.243036 -2.412360
H 1.753700 -4.533042 0.084594
H 2.139134 4.349516 -0.039856


