%chk=000170871.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000170871

0 1
 S    4.074100      -2.118300     -0.3596000    
 S    4.388600       2.787500     -0.3375000    
 O   -4.422400      0.6611000      0.5670000    
 O   -3.620400     -0.5738000      -1.208400    
 C    1.487500      -1.099100     -0.1417000    
 C    2.871700      -1.056700      0.5327000    
 C   0.3600000     -0.3589000      0.5897000    
 C  -0.9725000     -0.5222000     -0.1526000    
 C    3.491500      0.3452000      0.6892000    
 C   -2.129900      0.1726000      0.5647000    
 C    3.667100       1.142500     -0.6069000    
 C   -3.451500      3.0200001E-02 -0.1581000    
 C   -5.743800      0.5900000      2.1600001E-02
 H    1.184000      -2.151000     -0.2375000    
 H    1.557800     -0.7127000      -1.166400    
 H    2.776300      -1.490900       1.535100    
 H   0.6008000      0.7070000      0.6685000    
 H   0.2668000     -0.7508000       1.609200    
 H   -1.203900      -1.589200     -0.2623000    
 H  -0.8775000     -0.1181000      -1.168400    
 H    4.460800      0.2558000       1.199400    
 H    2.854700      0.9225000       1.372500    
 H   -2.244700     -0.2547000       1.567500    
 H   -1.910600       1.242200      0.6591000    
 H    2.701200       1.292800      -1.097700    
 H    4.321500      0.6225000      -1.310800    
 H    3.894400      -1.583100      -1.575800    
 H    5.553200       2.363300      0.1746000    
 H   -6.417900       1.129500      0.6922000    
 H   -6.071500     -0.4520000     -4.2300001E-02
 H   -5.772900       1.065900     -0.9633000    


%chk=000170871-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000170871

0 1
S 4.156882 -2.235757 -0.358585
S 4.300916 2.916052 -0.225826
O -4.436470 0.737886 0.584116
O -3.717336 -0.678108 -1.119725
C 1.521528 -1.145101 -0.219741
C 2.886525 -1.078011 0.500407
C 0.396064 -0.367201 0.505625
C -0.977848 -0.576793 -0.168802
C 3.461300 0.344616 0.715252
C -2.098802 0.204464 0.542903
C 3.670818 1.157945 -0.572015
C -3.458948 0.013813 -0.109155
C -5.814333 0.636910 0.043896
H 1.230252 -2.209537 -0.306963
H 1.620781 -0.766426 -1.257799
H 2.793376 -1.559414 1.492817
H 0.633387 0.715866 0.526133
H 0.345303 -0.698316 1.564120
H -1.230773 -1.654045 -0.180650
H -0.928906 -0.263981 -1.229421
H 4.426338 0.250653 1.248399
H 2.781472 0.906840 1.385701
H -2.182568 -0.098866 1.604914
H -1.877938 1.289888 0.560477
H 2.726315 1.325490 -1.115994
H 4.388097 0.668114 -1.250592
H 3.985619 -1.725266 -1.636030
H 5.498208 2.525589 0.353051
H -6.423204 1.264680 0.709291
H -6.156789 -0.411495 0.062016
H -5.846766 1.008610 -0.994119


