%chk=000118692.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118692

1 1
 S    1.832500     -0.3004000     -0.5486000    
 F   -1.036500       2.931500      0.6400000    
 F   -1.907200       1.129500       1.484400    
 F   -2.581200       2.793700      -1.539600    
 F   -3.658800       2.863800      0.3485000    
 F   -4.834200       1.427300      -1.571500    
 F   -3.080500      0.1682000      -1.828300    
 F   -5.041800      0.7048000       1.049600    
 F   -3.257000     -0.5341000      0.8951000    
 F   -6.237200     -0.6716000     -0.9418000    
 F   -4.483400      -1.934500      -1.195000    
 F   -6.462300      -1.465100       1.684300    
 F   -4.668200      -2.674200       1.474900    
 F   -6.424100      -3.120500      0.2607000    
 O    2.304800      0.5189000      -1.653400    
 O    1.268600      -1.616100     -0.8023000    
 O    6.943500     -0.9262000      -2.217100    
 O    8.135100      -2.472500      -1.046000    
 N    7.361100      0.1295000      0.7555000    
 N    3.096000     -0.4325000      0.5956000    
 C    5.954000      0.3356000      0.3335000    
 C    5.101900      0.6164000       1.564700    
 C    8.265000     -0.1186000     -0.4603000    
 C    3.627500      0.7929000       1.218900    
 C    7.893300       1.361200       1.501500    
 C    7.478100      -1.081800       1.691400    
 C   -1.614900       1.742200      0.3094000    
 C  -0.6019000      0.9067000     -0.4632000    
 C   -2.901300       2.050900     -0.4408000    
 C   0.6523000      0.6459000      0.3611000    
 C   -3.770000      0.8899000     -0.9091000    
 C   -4.297500     -3.4499999E-02  0.1792000    
 C   -5.165600      -1.196100     -0.2814000    
 C    7.802900      -1.312700      -1.240000    
 C   -5.693000      -2.117400      0.7899000    
 H    5.597400     -0.5708000     -0.1642000    
 H    5.919100       1.173000     -0.3734000    
 H    5.408500       1.539500       2.066000    
 H    5.161800     -0.1946000       2.296900    
 H    8.252800      0.7836000      -1.083100    
 H    9.291500     -0.2806000     -0.1123000    
 H    3.521400       1.646200      0.5405000    
 H    3.058000       1.002600       2.130500    
 H   -1.040900     -5.9200000E-02 -0.7335000    
 H  -0.3329000       1.420700      -1.393100    
 H    7.674300       2.249800      0.9023000    
 H    7.441100       1.425200       2.494100    
 H    8.975600       1.244000       1.617800    
 H    6.895200      -1.911500       1.281700    
 H    8.535100      -1.355900       1.769800    
 H    7.116400     -0.8143000       2.687800    
 H   0.4087000      8.5000001E-02   1.269000    
 H    1.113800       1.597900      0.6369000    
 H    3.045500      -1.231800       1.240900    
 H    6.621400      -1.688700      -2.743600    


%chk=000118692-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000118692

1 1
S 2.394283 1.473499 0.833325
F -1.749137 3.518050 0.106697
F -2.127624 1.636540 1.340881
F -2.308333 2.231199 -2.246718
F -3.981139 2.169727 -0.690318
F -3.874082 -0.012649 -2.329073
F -1.652763 -0.351115 -1.881609
F -4.216515 -0.234448 0.683451
F -2.087684 -1.077101 0.623542
F -5.195471 -2.114852 -0.914291
F -3.141364 -2.716087 -1.725093
F -4.157403 -2.914710 1.760825
F -2.398741 -3.830824 0.645453
F -4.511048 -4.481458 0.154101
O 3.366771 2.259677 -0.219944
O 2.203565 -0.141287 0.639356
O 5.769731 1.359765 -2.259517
O 4.606222 -0.661802 -2.404732
N 6.271294 -0.711332 0.353481
N 3.043926 1.860868 2.543666
C 5.862150 0.678675 0.913054
C 5.369789 0.701307 2.375361
C 6.707359 -0.517360 -1.116551
C 4.523159 1.995662 2.637378
C 7.470497 -1.270068 1.117390
C 5.106594 -1.712881 0.435316
C -1.674688 2.091191 0.061397
C -0.225316 1.664959 -0.169369
C -2.721745 1.640422 -1.018105
C 0.664630 2.319487 0.893870
C -2.886389 0.099105 -1.331680
C -3.268664 -0.860929 -0.144163
C -3.837744 -2.266561 -0.580299
C 5.564961 0.016931 -1.992803
C -3.721868 -3.392602 0.517777
H 5.081142 1.067790 0.237782
H 6.750679 1.324507 0.793923
H 6.225712 0.685709 3.073881
H 4.738894 -0.176115 2.607524
H 7.551766 0.187841 -1.125166
H 7.024203 -1.501204 -1.497455
H 4.824693 2.815718 1.962226
H 4.695536 2.354770 3.668718
H -0.153625 0.564610 -0.102695
H 0.075832 1.969255 -1.186042
H 8.324419 -0.583393 1.009780
H 7.203282 -1.370216 2.179116
H 7.727293 -2.259714 0.708950
H 4.162701 -1.223111 0.150479
H 5.315697 -2.549436 -0.247829
H 5.037155 -2.084088 1.468117
H 0.312817 2.146330 1.923080
H 0.898716 3.380064 0.722845
H 2.663142 1.111206 3.154086
H 5.016530 1.750678 -2.782575


