%chk=000109963.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000109963

0 1
 S  -0.6374000       1.100500     -0.6848000    
 F    1.503500       2.178800       1.228500    
 F    2.201600      0.2583000       1.950000    
 F   0.4519000      -1.047100      0.2708000    
 F  -0.3664000      0.3064000       1.757800    
 F    2.315000       1.626200      -1.284900    
 F    3.841200       1.520900      0.2511000    
 F    2.195700      -1.097400      -1.428600    
 F    4.148100     -0.2068000      -1.758800    
 F    4.926700     -0.8623000      0.7673000    
 F    4.247400      -2.568700     -0.3969000    
 F    2.976300      -1.747800       1.176100    
 O   2.3800001E-02  0.9031000      -1.960200    
 O  -0.9580000       2.434000     -0.2144000    
 N   -2.053400      0.1477000     -0.6937000    
 C    1.686700      0.8800000      0.8496000    
 C   0.3197000      0.2686000      0.5784000    
 C    2.747500      0.8665000     -0.2414000    
 C    3.217600     -0.4695000     -0.7960000    
 C   -2.838000     -2.8500000E-02  0.5392000    
 C    3.840600      -1.425700      0.1909000    
 C   -4.290300     -0.2766000      0.2503000    
 C   -5.166100      0.7985000      0.1542000    
 C   -4.744700      -1.579400      8.1900001E-02
 C   -6.515400      0.5676000     -0.1146000    
 C   -6.094000      -1.810300     -0.1864000    
 C   -6.979400     -0.7368000     -0.2851000    
 H   -2.029700     -0.6917000      -1.288000    
 H   -2.748200      0.8572000       1.178700    
 H   -2.427800     -0.8737000       1.104300    
 H   -4.815100       1.818700      0.2830000    
 H   -4.063700      -2.422900      0.1542000    
 H   -7.204600       1.403400     -0.1917000    
 H   -6.455200      -2.825900     -0.3196000    
 H   -8.029800     -0.9166000     -0.4945000    


%chk=000109963-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000109963

0 1
S -0.801654 0.673554 -0.610647
F 1.436576 1.444597 1.902547
F 2.644146 -0.495084 1.961128
F 0.945504 -1.536716 -0.111573
F -0.144669 -0.761321 1.732904
F 2.132401 1.859023 -0.765460
F 3.825540 1.726189 0.768323
F 2.790204 -0.539194 -1.871523
F 4.549906 0.900182 -1.661868
F 5.371330 -0.651533 0.701391
F 5.419652 -1.603660 -1.355604
F 3.790303 -2.175751 0.105621
O -0.330389 0.403505 -2.130867
O -1.007099 2.134624 0.048878
N -2.288054 -0.228633 -0.339045
C 1.883586 0.366267 1.107601
C 0.622528 -0.383338 0.614518
C 2.878025 0.967857 0.044478
C 3.684861 0.038351 -0.947523
C -3.191424 0.059239 0.795417
C 4.577925 -1.113175 -0.353346
C -4.633465 -0.159299 0.354906
C -5.179422 0.587747 -0.720953
C -5.447897 -1.099933 1.031868
C -6.523425 0.400079 -1.106853
C -6.796594 -1.284239 0.648657
C -7.336081 -0.535438 -0.421660
H -2.361369 -1.099168 -0.877214
H -3.014206 1.113116 1.081161
H -2.952148 -0.577451 1.668150
H -4.547508 1.309167 -1.251419
H -5.030451 -1.684565 1.860965
H -6.939363 0.982550 -1.936098
H -7.421207 -2.009582 1.181226
H -8.379959 -0.679269 -0.721383


