%chk=000059265.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059265

0 1
 S   9.3599997E-02  -1.652100      0.5228000    
 O    3.262800       2.523500      0.7175000    
 C    1.905100      0.5048000      0.6638000    
 C    3.014900       1.341200     -5.3900000E-02
 C   -3.676700     -0.1298000     -0.2148000    
 C   -5.061500     -0.6082000      0.2275000    
 C    1.537000     -0.7635000     -0.1462000    
 C   -2.575800      -1.056800      0.3099000    
 C   -6.203300      0.2717000     -0.2895000    
 C   -1.196100     -0.5541000     -0.1049000    
 C   -7.591700     -0.2473000      9.0499997E-02
 C    2.271000      0.1515000       2.115400    
 C    2.583400       1.813900      -1.448100    
 C   -8.692900      0.6271000     -0.5114000    
 C    4.284600      0.5962000     -0.1623000    
 C   -10.07560      9.5200002E-02 -0.1696000    
 C    5.318400     -9.8000001E-03 -0.2482000    
 C    6.546900     -0.7273000     -0.3530000    
 C    6.917100      -1.343600      -1.669700    
 C    7.338900     -0.8327000      0.7244000    
 H    1.026500       1.160500      0.7268000    
 H   -3.633900     -9.0400003E-02  -1.309900    
 H   -3.509600      0.8898000      0.1530000    
 H   -5.215300      -1.635500     -0.1258000    
 H   -5.103400     -0.6409000       1.323300    
 H    1.323600     -0.5367000      -1.193400    
 H    2.374000      -1.469900     -0.1367000    
 H   -2.642700      -1.110700       1.404000    
 H   -2.742400      -2.069300     -7.9200000E-02
 H   -6.076700       1.290200      9.7800002E-02
 H   -6.131600      0.3378000      -1.382400    
 H   -1.129800     -0.5111000      -1.197200    
 H   -1.046100      0.4549000      0.2895000    
 H   -7.689200     -0.2700000       1.182400    
 H   -7.706200      -1.278000     -0.2662000    
 H    1.413700     -0.2544000       2.660900    
 H    2.599100       1.038100       2.667800    
 H    3.077200     -0.5883000       2.157700    
 H    1.620300       2.334700      -1.400200    
 H    2.503800      0.9948000      -2.169500    
 H    3.302200       2.534500      -1.858400    
 H   -8.584300      0.6663000      -1.601600    
 H   -8.598200       1.653500     -0.1385000    
 H    3.939200       3.053200      0.2612000    
 H   -10.21370     -0.9184000     -0.5596000    
 H   -10.84720      0.7358000     -0.6080000    
 H   -10.22950      7.0799999E-02  0.9140000    
 H    6.992500     -0.5729000      -2.444300    
 H    6.157800      -2.070200      -1.978000    
 H    7.878700      -1.866000      -1.625400    
 H    8.280200      -1.370900      0.6803000    
 H    7.070800     -0.3864000       1.677400    


%chk=000059265-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059265

0 1
S 0.077563 -1.567546 0.747585
O 3.360658 2.574513 0.650921
C 2.025623 0.570550 0.684697
C 3.145765 1.314949 -0.127269
C -3.801735 -0.091694 -0.139922
C -5.206640 -0.647295 0.186224
C 1.600334 -0.740501 -0.016996
C -2.659775 -0.994018 0.386690
C -6.351600 0.246850 -0.341242
C -1.270468 -0.414863 0.070543
C -7.758599 -0.296907 -0.005925
C 2.455895 0.317356 2.144386
C 2.689711 1.709264 -1.556289
C -8.902127 0.598521 -0.535661
C 4.405256 0.537499 -0.188693
C -10.305033 0.052475 -0.192927
C 5.474461 -0.085930 -0.239332
C 6.712919 -0.811903 -0.358498
C 7.142351 -1.191731 -1.770465
C 7.455191 -1.135129 0.743296
H 1.168261 1.274845 0.684706
H -3.700960 0.027640 -1.238965
H -3.700243 0.924154 0.296078
H -5.308178 -1.665438 -0.244129
H -5.308480 -0.762725 1.285471
H 1.363535 -0.588569 -1.083892
H 2.400645 -1.498232 0.057245
H -2.766817 -1.119948 1.482797
H -2.747674 -2.004215 -0.059917
H -6.243606 1.267470 0.082636
H -6.253984 0.356138 -1.441883
H -1.116578 -0.327374 -1.021138
H -1.147105 0.580850 0.532366
H -7.858845 -0.403864 1.094624
H -7.869351 -1.317947 -0.427900
H 1.632014 -0.168305 2.696140
H 2.716916 1.266173 2.638831
H 3.338066 -0.349121 2.182525
H 1.737896 2.266022 -1.495631
H 2.555133 0.829374 -2.208333
H 3.446614 2.360440 -2.030179
H -8.802704 0.702764 -1.635619
H -8.788698 1.619106 -0.115883
H 4.153947 3.036217 0.274075
H -10.455199 -0.954888 -0.625584
H -11.103431 0.710132 -0.583509
H -10.441148 -0.030630 0.902012
H 7.265238 -0.290382 -2.399405
H 6.376435 -1.824305 -2.256323
H 8.096983 -1.744326 -1.759191
H 8.398707 -1.683878 0.646988
H 7.132754 -0.856841 1.751866


