%chk=000135810.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135810

0 1
 F   -3.289100     -0.9706000       2.386300    
 F   -3.711600      -3.068300       1.964400    
 F   -5.031200      -1.514000       1.195200    
 O    1.066000      -1.148300      0.4858000    
 O   -1.625200       1.790800     -0.6949000    
 O   0.9609000       2.531100      0.3070000    
 O    1.012100      -1.424700      -1.870400    
 O    3.454000     -0.6497000       1.706700    
 O   -3.139000      -2.425300     -0.8099000    
 O   -1.712000       1.808800      -3.003300    
 O  -0.8575000       3.396400       1.439100    
 O    2.494200      -2.986900      -1.033600    
 O    4.854700      0.8053000      0.5849000    
 N   -1.882000     -0.8098000      0.2988000    
 C  -0.4854000      0.9358000     -0.7361000    
 C  -0.9376000     -0.5278000     -0.7623000    
 C   0.4360000       1.213900      0.4530000    
 C    1.576400      0.1882000      0.4896000    
 C   0.2664000      -1.468400     -0.6565000    
 C    2.436300      0.3339000       1.742000    
 C   -2.900700      -1.736500      0.1782000    
 C   -2.137900       2.150300      -1.908300    
 C   0.2067000       3.531600      0.8506000    
 C    2.107600      -2.239300      -1.921900    
 C   -3.729700      -1.822400       1.425800    
 C   -3.325100       3.043300      -1.710700    
 C   0.8779000       4.852000      0.6226000    
 C    4.623400     -0.2829000       1.094100    
 C    2.788700      -2.089600      -3.248400    
 C    5.602700      -1.416800       1.132300    
 H   9.8700002E-02   1.150800      -1.642600    
 H   -1.454800     -0.7133000      -1.712300    
 H  -0.1321000       1.134200       1.389400    
 H    2.225900      0.3176000     -0.3855000    
 H  -9.1499999E-02  -2.496900     -0.5211000    
 H    2.847500       1.344300       1.849600    
 H    1.836900      0.1311000       2.636800    
 H   -1.755000     -0.3436000       1.192200    
 H   -3.022600       3.948500      -1.178200    
 H   -3.729300       3.330800      -2.685500    
 H   -4.100600       2.510100      -1.155000    
 H   0.9701000       5.039600     -0.4501000    
 H   0.2721000       5.648000       1.065000    
 H    1.860600       4.855600       1.100800    
 H    2.106400      -2.381900      -4.050500    
 H    3.666000      -2.741900      -3.281300    
 H    3.118400      -1.055900      -3.380000    
 H    5.193100      -2.276800      0.5966000    
 H    6.531600      -1.110900      0.6425000    
 H    5.825300      -1.679000       2.169600    


%chk=000135810-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135810

0 1
F -4.042578 -0.725773 1.991557
F -3.862966 -2.984787 2.186065
F -5.308604 -2.090820 0.687001
O 0.825977 -1.420102 0.507348
O -1.671761 1.728749 -0.717981
O 1.052392 2.303462 0.110491
O 0.893657 -1.543776 -1.898820
O 3.618039 -0.348113 1.731017
O -2.822812 -2.963609 -0.611516
O -1.806225 1.808710 -3.047806
O 0.636783 3.048067 2.286852
O 1.409612 -3.830042 -1.835199
O 4.126661 1.900732 1.365266
N -2.137413 -0.857288 0.150869
C -0.544413 0.765938 -0.825749
C -1.098714 -0.676118 -0.879276
C 0.353885 1.028049 0.390849
C 1.441783 -0.067779 0.542799
C 0.059510 -1.689995 -0.680094
C 2.183594 0.012510 1.884899
C -2.926360 -1.975898 0.162594
C -2.223832 2.193125 -1.937393
C 1.161182 3.237474 1.168812
C 1.546623 -2.720063 -2.375609
C -4.032928 -1.950985 1.254655
C -3.346885 3.162918 -1.663682
C 2.009847 4.404106 0.742277
C 4.502035 0.711824 1.484309
C 2.367337 -2.382739 -3.596659
C 5.925240 0.208170 1.422540
H 0.013085 0.954554 -1.759022
H -1.541244 -0.867382 -1.874195
H -0.235954 1.134300 1.321044
H 2.152186 0.031981 -0.299807
H -0.289981 -2.729378 -0.584359
H 2.111262 1.017302 2.330584
H 1.779206 -0.746436 2.571803
H -2.363375 -0.070536 0.766105
H -3.053977 3.886884 -0.886095
H -3.618712 3.685929 -2.591674
H -4.230825 2.615159 -1.289517
H 1.825603 4.668546 -0.310781
H 1.821245 5.266035 1.398892
H 3.067865 4.098189 0.839286
H 1.709060 -2.011956 -4.401704
H 2.904236 -3.277784 -3.941200
H 3.085632 -1.577801 -3.364831
H 5.970712 -0.778334 0.935285
H 6.556432 0.934880 0.890232
H 6.315574 0.090401 2.450036


