%chk=000115208.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115208

0 1
 S    6.031500       1.801900       1.028100    
 F   -3.976700     -0.9290000       2.254400    
 O    3.951500      -1.539800      -1.207700    
 N   0.1580000      -1.367400      -1.257400    
 N   -1.734600      -1.388700      0.9950000    
 N    2.457100      -1.541900      0.5491000    
 C   0.2551000      -2.306700     -0.1240000    
 C  -0.3378000      -1.768700       1.183100    
 C    1.719500      -2.694300      0.1100000    
 C   8.3300002E-02  4.9999999E-03  -1.043800    
 C  -0.9252000      0.5728000     -0.2369000    
 C   -1.984900     -0.2939000      0.3560000    
 C   0.5118000      -1.851400      -2.586800    
 C   0.9986000      0.8929000      -1.639200    
 C  -0.9849000       1.954800     -6.0000003E-04
 C   -3.413200      9.9600002E-02  0.1883000    
 C   0.9355000       2.271300      -1.414100    
 C  -5.1199999E-02   2.800500     -0.5902000    
 C    3.546300      -1.037000     -0.1603000    
 C   -4.344800     -0.2448000       1.161800    
 C   -3.801000      0.8097000     -0.9429000    
 C    4.214900      0.1273000      0.4374000    
 C   -5.680200      0.1256000       1.002100    
 C   -5.136400       1.179900      -1.102500    
 C   -6.075900      0.8378000     -0.1301000    
 C    3.585400       1.059400       1.283000    
 C    5.530700      0.3873000      0.2033000    
 C    4.467700       2.038000       1.684700    
 H  -0.2998000      -3.213600     -0.3984000    
 H  -0.3089000      -2.560600       1.941700    
 H   0.2160000     -0.9299000       1.620100    
 H    2.169200      -3.129800     -0.7875000    
 H    1.791400      -3.442800      0.9070000    
 H    1.585300      -1.754300      -2.777000    
 H  -3.6100000E-02  -1.305000      -3.363000    
 H   0.2473000      -2.909100      -2.694900    
 H    1.796300      0.5211000      -2.278300    
 H    2.246000      -1.159800       1.464900    
 H   -1.749800       2.383900      0.6412000    
 H    1.664700       2.928500      -1.879000    
 H  -9.4899997E-02   3.870500     -0.4103000    
 H   -3.102000       1.067800      -1.733100    
 H   -6.411700     -0.1411000       1.759200    
 H   -5.446100       1.728700      -1.987000    
 H   -7.115900       1.124600     -0.2552000    
 H    2.547800       1.050600       1.591500    
 H    6.236600     -0.1654000     -0.4013000    
 H    4.268000       2.881800       2.330100    


%chk=000115208-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000115208

0 1
S 6.369171 1.728566 0.953535
F -4.010288 -0.373607 2.538835
O 3.837385 -1.439421 -1.315142
N 0.215531 -1.262385 -1.266667
N -1.807304 -1.371987 0.937766
N 2.633098 -1.677210 0.666490
C 0.282010 -2.243110 -0.155727
C -0.376769 -1.690973 1.123411
C 1.743849 -2.724154 0.151778
C 0.035752 0.126877 -1.066192
C -1.073781 0.659461 -0.308435
C -2.085999 -0.243974 0.319913
C 0.794212 -1.725595 -2.545565
C 0.892054 1.050613 -1.740150
C -1.243603 2.067988 -0.225507
C -3.533353 0.126289 0.192704
C 0.696508 2.440079 -1.642806
C -0.368810 2.963344 -0.870764
C 3.613387 -1.078440 -0.112991
C -4.456798 0.003056 1.259741
C -4.054783 0.587048 -1.047548
C 4.408379 0.001377 0.551755
C -5.826573 0.289922 1.127154
C -5.425613 0.875620 -1.213297
C -6.316104 0.722569 -0.124723
C 4.082504 0.703529 1.780854
C 5.599228 0.443149 -0.012125
C 5.019270 1.654498 2.138145
H -0.275387 -3.152832 -0.468338
H -0.304360 -2.467592 1.906781
H 0.195596 -0.796398 1.457631
H 2.212780 -3.120255 -0.764316
H 1.681087 -3.549540 0.887842
H 1.902048 -1.687070 -2.570476
H 0.392869 -1.114584 -3.371681
H 0.477647 -2.772681 -2.713120
H 1.740612 0.665015 -2.314048
H 2.538083 -1.393302 1.641570
H -2.093694 2.455270 0.347614
H 1.387275 3.116810 -2.158822
H -0.518919 4.044332 -0.785156
H -3.364500 0.702548 -1.889567
H -6.482647 0.178791 1.995529
H -5.797538 1.215304 -2.185364
H -7.381927 0.944069 -0.243489
H 3.170057 0.549102 2.363582
H 6.059801 0.086140 -0.931234
H 5.022056 2.330042 2.991124


