%chk=000049062.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049062

0 1
 I    3.495400      -2.910400      0.5623000    
 F    5.307200     -0.4478000     -0.4134000    
 O  -0.7916000      0.3741000      0.1432000    
 O  -0.1648000       2.521400      0.7102000    
 N   -2.911800     -0.7833000     -5.7500001E-02
 C   -2.246100      0.5191000      0.2676000    
 C   -2.720400       1.643300     -0.7043000    
 C   -2.592700      0.9275000       1.719600    
 C   -2.491600      -1.878800      0.8264000    
 C   -2.710300      -1.203200      -1.450200    
 C   -4.216300       1.939700     -0.6762000    
 C   -3.302100      -3.136900      0.5647000    
 C   -1.250900      -1.527700      -1.720300    
 C   8.7899998E-02   1.376500      0.3740000    
 C    1.473500      0.8840000      0.1671000    
 C    1.751900     -0.4462000      0.4051000    
 C    2.439500       1.773200     -0.2573000    
 C    3.053700     -0.9077000      0.2101000    
 C    3.741200       1.311800     -0.4522000    
 C    4.048400     -2.8600000E-02 -0.2188000    
 H   -2.220300       2.585400     -0.4536000    
 H   -2.388800       1.448500      -1.730300    
 H   -1.999000      0.3656000       2.449200    
 H   -2.365000       1.983800       1.901400    
 H   -3.655600      0.7846000       1.943400    
 H   -1.418800      -2.089600      0.8410000    
 H   -2.737900      -1.605700       1.859000    
 H   -3.334300      -2.070500      -1.692400    
 H   -3.065800     -0.4531000      -2.162800    
 H   -4.539100       2.294600      0.3067000    
 H   -4.452000       2.725300      -1.401800    
 H   -4.807500       1.057800     -0.9391000    
 H   -4.373100      -2.922700      0.4772000    
 H   -2.970100      -3.672400     -0.3299000    
 H   -3.180500      -3.831000       1.404300    
 H  -0.6364000     -0.6372000      -1.869800    
 H  -0.7626000      -2.209900      -1.024300    
 H   -1.207300      -2.045700      -2.688300    
 H   0.9863000      -1.131800      0.7571000    
 H    2.212000       2.818100     -0.4461000    
 H    4.515500       1.995900     -0.7868000    


%chk=000049062-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000049062

0 1
I 3.994054 -2.701251 -0.806291
F 5.746336 -0.013825 -0.272289
O -0.619625 0.324141 0.091080
O -0.096493 2.542540 0.644776
N -2.827804 -0.823243 -0.020053
C -2.342064 0.471096 0.240335
C -2.686696 1.547459 -0.809516
C -2.520483 0.967946 1.684630
C -2.688789 -1.871297 1.031663
C -2.892326 -1.338586 -1.414034
C -4.202922 1.840447 -0.893451
C -3.695173 -3.030409 0.893671
C -1.589342 -1.988845 -1.938479
C 0.235395 1.361522 0.323186
C 1.683160 0.968143 0.157286
C 2.052874 -0.360539 -0.172714
C 2.681857 1.957078 0.341203
C 3.412862 -0.700652 -0.318294
C 4.042189 1.625887 0.195403
C 4.388311 0.301339 -0.132089
H -2.143710 2.461506 -0.518127
H -2.291974 1.258354 -1.799542
H -1.895459 0.406594 2.397281
H -2.214422 2.022829 1.741795
H -3.578652 0.875854 1.989978
H -1.652827 -2.272409 1.040211
H -2.853090 -1.393976 2.009264
H -3.715037 -2.074113 -1.459187
H -3.187897 -0.515642 -2.082402
H -4.594237 2.206648 0.072602
H -4.395820 2.623066 -1.649117
H -4.782731 0.942056 -1.171363
H -4.730283 -2.649854 0.826105
H -3.496506 -3.665447 0.012711
H -3.624764 -3.677295 1.786877
H -0.760632 -1.261998 -1.934665
H -1.288566 -2.855123 -1.321063
H -1.741806 -2.350807 -2.972332
H 1.267716 -1.107757 -0.307007
H 2.367974 2.973359 0.597104
H 4.837202 2.365206 0.329052


