%chk=000119558.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119558

0 1
 S   -3.930100     -5.0600000E-02 -0.3300000    
 O  -0.6637000       1.385100      0.9175000    
 O    3.504900      -1.878900     -0.4977000    
 O   -5.289100     -0.2081000      0.5563000    
 O    4.597900     -0.5864000       1.010800    
 O   -3.952400      -1.034100      -1.393600    
 O   -3.699800       1.354500     -0.5959000    
 N   -1.416400     -0.7566000      0.4240000    
 N    4.200900       1.593700     -0.6276000    
 C    1.918300      0.9100000     -6.3600004E-02
 C   0.8600000     -0.1942000     -0.1048000    
 C    3.243700      0.4876000     -0.7074000    
 C  -0.4712000      0.2578000      0.4703000    
 C   -2.771100     -0.5981000      0.9096000    
 C    3.867900     -0.6819000      3.2200001E-02
 H    2.081400       1.201000      0.9833000    
 H    1.532700       1.800600     -0.5774000    
 H    1.187400      -1.063100      0.4770000    
 H   0.6952000     -0.5167000      -1.139600    
 H    3.105000      0.2230000      -1.761100    
 H   -3.106100      -1.576000       1.266700    
 H   -2.792900      0.1246000       1.730300    
 H   -1.165100      -1.650600      1.2200000E-02
 H    5.097900       1.305800      -1.016300    
 H    4.370100       1.843500      0.3460000    
 H    3.900300      -2.630700     -7.1999999E-03
 H   -5.397600      0.4459000       1.286300    


%chk=000119558-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000119558

0 1
S -3.941207 0.281254 -0.259806
O -0.561410 1.949026 1.001306
O 4.176972 -1.818317 -1.355350
O -3.962141 -1.616260 -0.005000
O 3.266184 -1.746094 0.781943
O -2.990528 0.562680 -1.546353
O -5.464642 0.831059 -0.260350
N -1.536543 -0.156797 1.199809
N 4.307296 1.116216 -0.631684
C 1.989090 0.834111 0.170907
C 0.691267 0.004583 0.125973
C 3.107348 0.260438 -0.717713
C -0.472194 0.714278 0.798843
C -2.781529 0.333053 1.552005
C 3.470874 -1.184245 -0.319790
H 2.344602 0.890979 1.217806
H 1.788409 1.865752 -0.163249
H 0.852276 -0.988769 0.586272
H 0.381655 -0.171683 -0.926671
H 2.778096 0.244182 -1.772798
H -3.428538 -0.336576 2.127360
H -2.789434 1.401039 1.801685
H -1.450933 -1.160779 1.011070
H 5.044134 0.892556 -1.306438
H 4.658634 1.257899 0.320523
H 4.473781 -2.720460 -1.055333
H -4.443419 -2.032026 -0.774666


