%chk=000083501.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083501

0 1
 S   -6.036500       1.781100     -0.6727000    
 O   -3.628200      9.4800003E-02  0.2754000    
 O   -2.417600      -1.759100     -0.3789000    
 C    2.555600     -0.3112000     -7.9499997E-02
 C    3.813800      0.5268000      0.1663000    
 C    1.258600      0.4199000      0.2760000    
 C    5.109200     -0.1944000     -0.2130000    
 C   3.4499999E-02 -0.4592000     -1.3000000E-03
 C    6.334900      0.6574000      0.1201000    
 C   -1.278100      0.2523000      0.3147000    
 C    7.627000     -6.8800002E-02 -0.2188000    
 C   -2.485200     -0.6053000      2.4800001E-02
 C   -4.848600     -0.6125000      3.4600001E-02
 C   -6.039300      0.2784000      0.3522000    
 H    2.621900      -1.236600      0.5060000    
 H    2.525600     -0.6065000      -1.135700    
 H    3.850900      0.8061000       1.226600    
 H    3.741400       1.460900     -0.4045000    
 H    1.187400       1.344500     -0.3092000    
 H    1.274900      0.7056000       1.334400    
 H    5.099200     -0.4294000      -1.284000    
 H    5.167100      -1.147400      0.3269000    
 H   3.7700001E-02 -0.7665000      -1.054900    
 H   0.1046000      -1.379900      0.5919000    
 H    6.335600      0.9092000       1.187000    
 H    6.294200       1.601100     -0.4362000    
 H   -1.303000      0.5274000       1.375000    
 H   -1.355600       1.162900     -0.2900000    
 H    7.673200     -0.3096000      -1.285700    
 H    7.713500      -1.001200      0.3482000    
 H    8.489800      0.5586000      2.5699999E-02
 H   -4.883500     -0.9420000      -1.011200    
 H   -4.881300      -1.497200      0.6813000    
 H   -6.976400     -0.2617000      0.1882000    
 H   -6.001300      0.5987000       1.398200    
 H   -7.150800       2.319200     -0.1558000    


%chk=000083501-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083501

0 1
S -6.016497 1.890773 -0.628537
O -3.687399 0.085060 0.407651
O -2.557480 -1.754250 -0.465783
C 2.588011 -0.309206 -0.137316
C 3.843230 0.528756 0.194210
C 1.264560 0.386380 0.253073
C 5.164772 -0.176122 -0.186648
C 0.020883 -0.468112 -0.074898
C 6.423310 0.656827 0.147591
C -1.292363 0.231523 0.323991
C 7.737879 -0.060182 -0.229665
C -2.524873 -0.606669 0.032656
C -4.973599 -0.616576 0.145775
C -6.086796 0.357202 0.502175
H 2.653307 -1.287653 0.382980
H 2.575343 -0.536604 -1.223740
H 3.852833 0.761428 1.279952
H 3.783654 1.504706 -0.331885
H 1.195807 1.362427 -0.271811
H 1.280929 0.617423 1.339213
H 5.158019 -0.407827 -1.272506
H 5.223687 -1.152853 0.338029
H -0.000889 -0.699896 -1.157110
H 0.088601 -1.443784 0.443701
H 6.426960 0.891845 1.231754
H 6.366721 1.630629 -0.380716
H -1.295962 0.481222 1.403592
H -1.405293 1.199245 -0.203066
H 7.771782 -0.280341 -1.313542
H 7.833044 -1.021568 0.309767
H 8.622289 0.555486 0.017925
H -5.009386 -0.924708 -0.913707
H -5.016749 -1.521868 0.781503
H -7.061911 -0.135750 0.357424
H -5.996236 0.694057 1.546522
H -7.384990 1.985377 -0.826456


