%chk=000173468.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173468

0 1
 S   -3.596100      -1.439800      -1.152600    
 S    3.576100      -1.482900       1.122800    
 O   -4.372900     -0.9962000       1.724600    
 O    4.355000     -0.9739000      -1.743000    
 O   -5.062400     -0.7899000      -1.466000    
 O    5.045200     -0.8472000       1.451600    
 O   -2.832400      -1.385100      -2.389500    
 O   -3.798100      -2.700700     -0.4581000    
 O    2.812600      -1.454600       2.360700    
 O    3.772700      -2.727700      0.3982000    
 C  -2.0000001E-03   2.144800      2.8300000E-02
 C   -1.158200       1.312600      0.4698000    
 C    1.207500       1.277600     -0.4557000    
 C   0.6073000       3.099300       1.123500    
 C  -0.4955000       3.131900      -1.087200    
 C   -1.767300      0.4328000     -0.4250000    
 C    1.755700      0.4147000      0.4405000    
 C   -1.629000       1.412700       1.779100    
 C    1.621800       1.447800      -1.739500    
 C   -2.847200     -0.3468000     -1.0500000E-02
 C    2.832100     -0.3596000      7.3000002E-03
 C   -2.708700      0.6332000       2.193600    
 C    2.698200      0.6737000      -2.172600    
 C   -3.317800     -0.2466000       1.298900    
 C    3.303300     -0.2301000      -1.299300    
 H  -0.1313000       3.834700       1.465400    
 H   0.9688000       2.558400       2.005700    
 H    1.460600       3.662500      0.7239000    
 H   -1.325000       3.743900     -0.7079000    
 H   0.2884000       3.831700      -1.401700    
 H  -0.8794000       2.617300      -1.975900    
 H   -1.393500      0.3596000      -1.442000    
 H    1.373200      0.3245000       1.450400    
 H   -1.193000       2.080400       2.513900    
 H    1.192800       2.126400      -2.463100    
 H   -3.065700      0.7218000       3.216300    
 H    3.060700      0.7784000      -3.191800    
 H   -4.554100     -0.7901000       2.657600    
 H    4.731100      -1.508500      -1.027100    
 H   -5.048500      0.1062000      -1.877500    
 H    5.035200      3.9500002E-02   1.882900    


%chk=000173468-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000173468

0 1
S -3.435358 -1.519144 -1.208794
S 3.380165 -1.676206 1.006995
O -4.481837 -0.880768 1.547354
O 4.449726 -0.973914 -1.900144
O -5.220214 -1.051223 -1.215714
O 4.468182 -0.587191 2.039160
O -2.879977 -1.143105 -2.673591
O -3.274631 -3.010166 -0.612827
O 2.237528 -2.293204 1.961262
O 4.352707 -2.681706 0.148015
C 0.068677 2.369539 -0.024701
C -1.103744 1.490132 0.474802
C 1.209004 1.460476 -0.548073
C 0.657126 3.262082 1.107486
C -0.487558 3.309275 -1.135559
C -1.668618 0.535937 -0.413499
C 1.696973 0.426159 0.280602
C -1.677063 1.610115 1.763918
C 1.844642 1.644476 -1.807545
C -2.758781 -0.235644 -0.003941
C 2.768821 -0.371060 -0.155220
C -2.788554 0.833152 2.163700
C 2.907916 0.832721 -2.236422
C -3.346959 -0.104124 1.271047
C 3.413646 -0.208910 -1.416661
H -0.091765 3.984938 1.480086
H 1.025394 2.662705 1.959336
H 1.512887 3.837622 0.714270
H -1.330389 3.898086 -0.733675
H 0.284383 4.020933 -1.479823
H -0.860457 2.745728 -2.009027
H -1.263359 0.388878 -1.421315
H 1.235820 0.221769 1.253735
H -1.267166 2.327897 2.479637
H 1.496445 2.430705 -2.483447
H -3.221668 0.965042 3.162753
H 3.376458 0.972545 -3.214776
H -4.718919 -0.875429 2.506153
H 4.652659 -1.748981 -1.273239
H -5.526380 -1.224694 -0.272886
H 4.884439 -1.158741 2.749566


