%chk=000067922.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067922

0 1
 S    3.660100      -1.082000     -0.6280000    
 F   -1.664700       1.396200       1.319200    
 F   9.0200000E-02   1.825500      0.1297000    
 F  -0.8750000      -1.149700       1.735200    
 F   0.5127000      0.3942000       2.365100    
 F   -2.043500       1.512600      -1.355200    
 F  -0.5867000     -4.9500000E-02  -1.700200    
 F    1.631700      -1.856700       1.513900    
 F   0.6496000      -1.744400     -0.4193000    
 F   -2.028800      -1.833800     -0.2751000    
 F   -3.047200     -0.9059000      -1.951700    
 F    2.790500      0.6111000       1.098400    
 F    1.855200      0.7519000     -0.8574000    
 F   -3.416500     -0.2993000       1.494600    
 F   -4.608100      -1.493600      0.1280000    
 F   -5.664900      0.9623000      0.7093000    
 F   -3.889200       1.933000     -0.1032000    
 F   -5.150800      0.7253000      -1.398700    
 O    3.177900      -1.749300      -1.822200    
 O    4.245800      -1.855800      0.4507000    
 N    4.749900      0.1392000      -1.096400    
 C  -0.7671000      0.8213000      0.4691000    
 C   6.0999999E-03 -0.2261000       1.258500    
 C   -1.502400      0.3939000     -0.7936000    
 C    1.146500     -0.9820000      0.5854000    
 C   -2.592100     -0.6642000     -0.6866000    
 C    2.302400     -0.1340000      6.8200000E-02
 C   -3.800600     -0.3954000      0.1975000    
 C   -4.639100      0.8085000     -0.1543000    
 C    5.213500       1.125400     -0.1055000    
 C    6.586600       1.576100     -0.4828000    
 C    7.658100       1.445200      0.3074000    
 H    4.611700      0.5350000      -2.036000    
 H    4.537100       1.986100     -0.1113000    
 H    5.217200      0.6879000      0.8981000    
 H    6.712000       2.052200      -1.452100    
 H    8.628900       1.800300     -2.0900000E-02
 H    7.589100      0.9853000       1.287000    


%chk=000067922-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000067922

0 1
S 4.150710 -1.271083 0.564830
F -2.084282 1.076171 1.697802
F -0.051572 1.800523 0.945198
F -1.222514 -1.571448 1.603976
F -0.038654 -0.117620 2.901438
F -2.018155 1.998599 -0.867426
F -0.370007 0.531923 -1.447408
F 1.429251 -2.135815 1.877761
F 0.800870 -1.660378 -0.278186
F -2.038735 -1.625804 -1.000561
F -2.746582 -0.059696 -2.499153
F 2.516998 0.610134 1.992147
F 2.232932 0.657162 -0.274169
F -3.926293 -0.810704 0.858146
F -4.720275 -1.384808 -1.205240
F -6.240317 0.545833 -0.164093
F -4.488039 1.861050 0.400906
F -4.962390 1.478539 -1.789024
O 3.796416 -2.646309 -0.200995
O 4.900274 -1.187060 1.990869
N 5.062695 -0.230541 -0.571723
C -0.983559 0.730634 0.882215
C -0.287710 -0.511780 1.565421
C -1.498036 0.703477 -0.613087
C 1.068125 -1.091486 0.987768
C -2.583318 -0.328004 -1.118505
C 2.309348 -0.176962 0.859812
C -4.029614 -0.384348 -0.483237
C -4.935773 0.904026 -0.514810
C 5.646244 1.047725 -0.073208
C 6.436393 1.664558 -1.209908
C 7.790114 1.724201 -1.242209
H 4.648840 -0.251449 -1.515499
H 4.860294 1.752684 0.270928
H 6.298684 0.805367 0.780916
H 5.848835 2.093742 -2.034724
H 8.319452 2.200812 -2.074727
H 8.405449 1.304934 -0.437441


