%chk=000106086.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106086

0 1
 S   0.3401000      0.2491000      0.6671000    
 F   -1.702900       1.798400       1.053100    
 F   -1.318900       1.293000      -1.031900    
 F   -2.365400     -0.8180000       1.586100    
 F   -1.912100      -1.362200     -0.4764000    
 F   -3.699500      0.5873000      -1.353700    
 F   -4.145200       1.086000      0.7177000    
 F   -4.424600      -2.065700     -0.7962000    
 F   -4.868200      -1.458200       1.246100    
 F   -6.241300     -0.1638000      -1.720000    
 F   -6.654600      0.3966000      0.3467000    
 F   -7.080800      -1.624000     -0.3300000    
 O   0.3293000     -0.1244000       2.069300    
 O   0.7756000     -0.7038000     -0.3368000    
 O    5.971100     -0.3041000     -0.2786000    
 O    8.091100      0.5702000     -0.4775000    
 N    1.239400       1.699300      0.4842000    
 C   -1.313600      0.7897000      0.2304000    
 C   -2.330900     -0.3425000      0.3148000    
 C   -3.737800      7.0900001E-02 -9.6799999E-02
 C    1.694900       2.087600     -0.8727000    
 C    3.216700       2.172200     -0.9186000    
 C   -4.810700      -1.005600     -3.9200000E-02
 C    3.889400      0.8386000     -0.5902000    
 C   0.8697000       2.873900       1.310700    
 C   -6.206600     -0.6043000     -0.4451000    
 C    5.407200      0.9587000     -0.6045000    
 C    7.335000     -0.3634000     -0.2491000    
 C    7.776800      -1.741500      0.1033000    
 C    6.937900      -2.924100     -0.2732000    
 C    8.939100      -1.865900      0.7607000    
 H    1.261100       3.053100      -1.158500    
 H    1.347100       1.370800      -1.624000    
 H    3.523800       2.499200      -1.919200    
 H    3.563400       2.937200     -0.2131000    
 H    3.576800      6.9399998E-02  -1.307000    
 H    3.579500      0.4749000      0.3967000    
 H   0.5510000       2.559700       2.308400    
 H   6.9600001E-02   3.451200      0.8397000    
 H    1.743100       3.520600       1.440200    
 H    5.749500       1.265900      -1.599700    
 H    5.731700       1.703200      0.1322000    
 H    5.994100      -2.919500      0.2817000    
 H    6.712400      -2.904100      -1.344500    
 H    7.445100      -3.871100     -6.0199998E-02
 H    9.317400      -2.842100       1.047200    
 H    9.542700      -1.007200       1.036400    


%chk=000106086-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106086

0 1
S 0.202607 0.337985 1.365337
F -2.329814 1.585908 1.940968
F -1.526812 2.020367 -0.153615
F -2.579542 -1.229818 1.064566
F -2.172307 -0.443673 -1.060787
F -4.307856 1.598573 -0.374874
F -4.816262 0.176369 1.339491
F -4.750657 -0.218636 -2.253334
F -4.581153 -1.987878 -0.811523
F -7.053314 0.672287 -0.609172
F -6.944848 -1.359949 0.408079
F -7.198428 -1.232313 -1.837288
O 0.221181 0.495143 2.972404
O 0.483544 -1.059840 0.603850
O 6.186271 -0.402977 -0.348128
O 8.132836 0.524782 -1.230952
N 1.364827 1.562980 0.670251
C -1.775197 1.009680 0.798446
C -2.679729 -0.104249 0.217345
C -4.209696 0.255915 0.065453
C 1.572606 1.479402 -0.797123
C 3.071229 1.647504 -1.143462
C -5.017577 -0.650402 -0.937600
C 3.958539 0.528111 -0.557217
C 1.331588 2.886269 1.323570
C -6.579565 -0.641323 -0.731787
C 5.420457 0.714685 -0.964433
C 7.572027 -0.381073 -0.564112
C 8.240427 -1.551965 0.095145
C 7.390434 -2.546108 0.858532
C 9.592404 -1.649414 -0.037259
H 0.965745 2.249308 -1.316196
H 1.237684 0.480759 -1.133550
H 3.142953 1.653187 -2.250146
H 3.428936 2.640009 -0.803767
H 3.601087 -0.458372 -0.908244
H 3.878630 0.523222 0.544559
H 1.091797 2.761088 2.392736
H 0.609702 3.582348 0.851395
H 2.345612 3.318841 1.256242
H 5.561970 0.674383 -2.061230
H 5.840412 1.672870 -0.603668
H 6.837428 -2.050035 1.676047
H 6.629205 -3.003936 0.201825
H 8.016363 -3.346434 1.287994
H 10.151238 -2.475803 0.414818
H 10.151518 -0.896577 -0.603583


