%chk=000097117.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097117

0 1
 S   0.4711000     -0.2359000       1.306700    
 O  -7.8000002E-02   1.500700     -0.5897000    
 C   -1.954700      0.2226000      2.8600000E-02
 C    2.074000     -0.2017000      0.5258000    
 C   -2.910800       1.177900     -0.3168000    
 C   -2.344500      -1.090700      0.2918000    
 C  -0.5519000      0.5957000      0.1140000    
 C    2.257700     -0.8122000     -0.7143000    
 C    3.142200      0.4359000       1.155800    
 C   -4.256500      0.8199000     -0.3989000    
 C   -3.690200      -1.448500      0.2095000    
 C   -4.646100     -0.4932000     -0.1358000    
 C    3.511400     -0.7855000      -1.325200    
 C    4.395900      0.4628000      0.5446000    
 C    4.580400     -0.1479000     -0.6958000    
 H   -2.626500       2.206800     -0.5216000    
 H   -1.631600      -1.872500      0.5368000    
 H    1.438700      -1.317300      -1.220400    
 H    3.017200      0.9176000       2.122400    
 H   -5.001000       1.563800     -0.6672000    
 H   -3.993600      -2.472300      0.4079000    
 H   -5.693700     -0.7721000     -0.2012000    
 H    3.655400      -1.261500      -2.290700    
 H    5.228500      0.9593000       1.034500    
 H    5.556500     -0.1271000      -1.171500    


%chk=000097117-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097117

0 1
S 0.487870 -1.043081 0.648894
O -0.110475 0.969656 -1.150137
C -2.064022 -0.020936 -0.106289
C 2.177715 -0.493169 0.166910
C -2.942442 0.838337 -0.823598
C -2.603119 -0.978366 0.793571
C -0.598337 0.141082 -0.351693
C 2.586972 -0.479856 -1.185584
C 3.078316 -0.143142 1.199267
C -4.335990 0.740508 -0.641150
C -3.998792 -1.074444 0.970804
C -4.867946 -0.216593 0.255879
C 3.912554 -0.107530 -1.503654
C 4.406507 0.214850 0.872135
C 4.824857 0.235540 -0.478476
H -2.509850 1.570292 -1.513355
H -1.940286 -1.645563 1.354705
H 1.881349 -0.745927 -1.977190
H 2.743700 -0.146024 2.241714
H -5.007020 1.405735 -1.195075
H -4.409360 -1.814914 1.665362
H -5.951737 -0.293335 0.397305
H 4.230076 -0.089647 -2.551892
H 5.106336 0.482992 1.671136
H 5.853024 0.518137 -0.730287


