%chk=000175594.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175594

0 1
 S    3.265500      -2.347400     -0.2727000    
 S    5.439500     -0.4476000     -0.9142000    
 O  -0.9500000      0.7112000       1.639400    
 O   -1.925000       1.388200     -0.9777000    
 O   0.6603000       1.528500     -0.5661000    
 O   -3.304500      -1.609400      0.5921000    
 O   -5.682500     -0.3178000     -0.1745000    
 N    3.061200      0.2880000      0.3375000    
 C  -0.7358000     -0.1339000      0.5103000    
 C   -1.906800      4.9800001E-02 -0.4845000    
 C   0.6471000      0.1816000     -9.8600000E-02
 C   -3.285500     -0.2570000      0.1398000    
 C    1.775500      1.1100000E-02  0.9228000    
 C   -4.451800     -5.1800001E-02 -0.8272000    
 C    3.486300       1.698900      0.4268000    
 C    3.906600     -0.6926000     -0.2534000    
 H  -0.7287000      -1.170600      0.8668000    
 H   -1.739500     -0.6163000      -1.339300    
 H   0.8169000     -0.4616000     -0.9687000    
 H   -3.462600      0.3826000       1.013500    
 H    1.742800     -0.9930000       1.354200    
 H    1.645900      0.6931000       1.772000    
 H   -4.377500     -0.7448000      -1.671400    
 H   -4.484200      0.9699000      -1.217500    
 H  -0.4242000      0.3603000       2.377600    
 H   -2.031300       1.981400     -0.2143000    
 H   0.4225000       2.103800      0.1811000    
 H   -2.772200      -1.658400       1.403800    
 H    2.729100       2.326400      0.9042000    
 H    3.679000       2.075400     -0.5822000    
 H    4.408900       1.751600       1.012700    
 H   -5.762100      0.3052000      0.5679000    
 H    4.318500      -2.917900     -0.8758000    


%chk=000175594-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000175594

0 1
S 2.423011 -2.413839 -0.519140
S 5.120061 -1.037036 -1.229149
O -0.825914 0.627451 1.939695
O -1.929790 2.311664 0.149054
O 0.801380 2.021842 -0.280529
O -3.317527 -0.151008 1.523633
O -4.761830 -1.716125 -0.147485
N 3.088354 0.124450 0.213086
C -0.748508 0.196649 0.530840
C -1.928821 0.879260 -0.222162
C 0.627386 0.582954 -0.051115
C -3.294111 0.234825 0.095362
C 1.765977 0.113511 0.883619
C -3.593323 -1.027723 -0.739200
C 3.844858 1.397944 0.296517
C 3.595600 -0.946074 -0.467628
H -0.845404 -0.906797 0.462098
H -1.763639 0.868225 -1.315390
H 0.726169 0.054583 -1.024357
H -4.077142 1.001957 -0.081178
H 1.557167 -0.900654 1.268056
H 1.803060 0.795133 1.747979
H -2.772441 -1.759889 -0.662495
H -3.761252 -0.774220 -1.803611
H -1.698167 0.253008 2.271652
H -1.757367 2.318391 1.136745
H -0.093754 2.470188 -0.263725
H -4.030373 -0.841173 1.618276
H 3.123153 2.226340 0.222991
H 4.567399 1.442179 -0.532110
H 4.399922 1.452421 1.252322
H -5.600313 -1.317337 -0.491627
H 3.337580 -3.194199 -1.196626


