%chk=000117452.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117452

0 1
 S    8.091900      -1.790100      0.6392000    
 C   -6.626000     -8.5000001E-02 -1.2200000E-02
 C   -5.226900     -0.4086000     -0.6016000    
 C   -4.027000      2.4599999E-02  0.2518000    
 C   -2.706900     -0.2881000     -0.4613000    
 C   -1.466900      0.1443000      0.3288000    
 C  -0.1541000     -9.9900000E-02 -0.4197000    
 C    1.085600      0.3311000      0.3712000    
 C    2.398400      0.1150000     -0.3851000    
 C   -7.747900     -0.5311000     -0.9642000    
 C   -6.775000       1.417800      0.2771000    
 C   -6.776800     -0.8546000       1.314800    
 C    3.596900      0.5910000      0.4393000    
 C    4.908600      0.4058000     -0.3272000    
 C    6.108000      0.8521000      0.5117000    
 C    7.441700      0.7807000     -0.2427000    
 C    7.876300     -0.6052000     -0.7200000    
 H   -5.155900      -1.488100     -0.7909000    
 H   -5.146700      7.5900003E-02  -1.584200    
 H   -4.066200       1.100400      0.4505000    
 H   -4.034800     -0.4912000       1.217400    
 H   -2.646700      -1.365400     -0.6596000    
 H   -2.698600      0.2143000      -1.436700    
 H   -1.548000       1.212000      0.5679000    
 H   -1.445000     -0.3934000       1.284600    
 H  -7.1099997E-02  -1.166000     -0.6642000    
 H  -0.1780000      0.4427000      -1.372800    
 H    1.117300     -0.2237000       1.317200    
 H   0.9897000       1.392900      0.6305000    
 H    2.365600      0.6605000      -1.335900    
 H    2.512300     -0.9488000     -0.6254000    
 H   -8.737900     -0.3304000     -0.5399000    
 H   -7.684500      -1.605100      -1.171700    
 H   -7.680700     -2.3000001E-03  -1.921400    
 H   -7.792300       1.653500      0.6109000    
 H   -6.095900       1.758000       1.065300    
 H   -6.576200       2.011000     -0.6223000    
 H   -7.788600     -0.7360000       1.720500    
 H   -6.084800     -0.4961000       2.083600    
 H   -6.603300      -1.927400       1.174300    
 H    3.469800       1.649500      0.6971000    
 H    3.638500      3.0999999E-02   1.381500    
 H    5.015700     -0.6494000     -0.6020000    
 H    4.874700      0.9834000      -1.258800    
 H    5.954100       1.893700      0.8217000    
 H    6.156200      0.2650000       1.435600    
 H    8.226000       1.201800      0.3998000    
 H    7.383600       1.440900      -1.117600    
 H    7.154500      -1.017100      -1.431600    
 H    8.833600     -0.5221000      -1.245400    
 H    8.473300      -2.826300     -0.1217000    


%chk=000117452-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117452

0 1
S 7.976288 -1.973789 0.644011
C -6.692368 -0.159186 0.036390
C -5.281301 -0.391494 -0.593098
C -4.060911 0.080423 0.230326
C -2.724508 -0.155251 -0.511383
C -1.484428 0.276482 0.303289
C -0.152040 0.057161 -0.448356
C 1.091569 0.466949 0.372315
C 2.422193 0.253370 -0.383987
C -7.753999 -0.734855 -0.940466
C -6.963237 1.356410 0.234702
C -6.816009 -0.890956 1.399744
C 3.667275 0.644558 0.443347
C 4.998023 0.427251 -0.312051
C 6.235234 0.795040 0.537581
C 7.584411 0.689314 -0.214401
C 7.911698 -0.704017 -0.781516
H -5.167969 -1.477580 -0.798384
H -5.258501 0.114620 -1.581996
H -4.154377 1.159786 0.465486
H -4.030861 -0.453023 1.201587
H -2.634710 -1.231168 -0.771183
H -2.739688 0.395321 -1.475571
H -1.579346 1.348684 0.575528
H -1.461900 -0.285518 1.260487
H -0.065129 -1.012295 -0.733816
H -0.169486 0.631018 -1.398712
H 1.112046 -0.112634 1.318963
H 1.002963 1.534499 0.664261
H 2.406952 0.841783 -1.325520
H 2.504278 -0.812064 -0.685181
H -8.777310 -0.586635 -0.546193
H -7.603176 -1.820333 -1.095567
H -7.694890 -0.239189 -1.928369
H -7.993858 1.523350 0.601532
H -6.270449 1.802650 0.971196
H -6.849259 1.907019 -0.718838
H -7.841357 -0.790747 1.804054
H -6.118685 -0.475488 2.149884
H -6.597998 -1.970916 1.292178
H 3.586818 1.709444 0.747530
H 3.682424 0.053260 1.382652
H 5.061528 -0.634864 -0.623274
H 4.995036 1.032556 -1.243535
H 6.124349 1.835229 0.906376
H 6.262124 0.146653 1.436470
H 8.406721 1.004004 0.457521
H 7.581093 1.398351 -1.068629
H 7.147279 -1.036400 -1.502662
H 8.899514 -0.698159 -1.271295
H 8.407539 -3.041124 -0.127226


