%chk=000052729.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052729

0 1
 F   -6.141200     -5.2400000E-02  -1.294900    
 F   -4.686700      -1.641600      -1.546200    
 F   -5.674300      -1.368800      0.3719000    
 O    5.210300     -0.9609000      0.3263000    
 O    5.481900       1.288400     -0.1102000    
 N    1.714900     -0.3640000       1.340400    
 C   0.4581000     -0.3456000      0.6034000    
 C  -0.6879000      4.8799999E-02   1.552800    
 C   -1.901200      0.5973000      0.8409000    
 C   0.2498000      -1.722700     -2.6900001E-02
 C    2.834200     -0.6512000      0.4557000    
 C   -2.901700     -0.2716000      0.4353000    
 C    4.142400     -0.6583000       1.230100    
 C   -1.992300       1.960100      0.6074000    
 C   -4.022900      0.2358000     -0.2212000    
 C   -3.113500       2.467500     -4.9300000E-02
 C   -4.128800       1.605300     -0.4636000    
 C   -5.107700     -0.6862000     -0.6655000    
 C    5.793100      0.1171000     -0.2773000    
 C    6.892800     -0.3699000      -1.191600    
 C    7.580600      0.7729000      -1.917700    
 H   0.5219000      0.4053000     -0.1953000    
 H  -0.3406000      0.8197000       2.255900    
 H  -0.9770000     -0.8017000       2.185300    
 H    1.675900      -1.057600       2.087000    
 H   0.9212000      -1.907100     -0.8714000    
 H   0.3698000      -2.531900      0.7027000    
 H  -0.7573000      -1.814600     -0.4442000    
 H    2.890500      9.2500001E-02 -0.3486000    
 H    2.760200      -1.632500     -2.3499999E-02
 H   -2.827200      -1.337700      0.6322000    
 H    4.133900      -1.448300       1.989800    
 H    4.317200      0.2881000       1.756400    
 H   -1.206100       2.639500      0.9237000    
 H   -3.195500       3.533800     -0.2386000    
 H   -4.993900       2.019500     -0.9738000    
 H    6.455000      -1.053800      -1.926400    
 H    7.629000     -0.9128000     -0.5895000    
 H    8.034500       1.473000      -1.208400    
 H    8.369400      0.3891000      -2.572000    
 H    6.868400       1.333700      -2.532100    


%chk=000052729-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052729

0 1
F -6.646478 0.171460 -0.116904
F -5.451505 -1.257359 -1.402894
F -5.566994 -1.587577 0.834006
O 5.444578 -0.807178 0.623990
O 5.290596 1.262825 -0.445174
N 1.706228 -0.769140 1.168902
C 0.468294 -0.455174 0.409699
C -0.643339 -0.081485 1.436418
C -1.894410 0.496708 0.797546
C 0.017620 -1.583482 -0.554173
C 2.956657 -0.877907 0.388927
C -3.071242 -0.274711 0.650511
C 4.145123 -0.543083 1.309314
C -1.900640 1.833389 0.317103
C -4.221040 0.277497 0.039683
C -3.049076 2.384318 -0.291405
C -4.219032 1.608683 -0.436763
C -5.442341 -0.573987 -0.148349
C 5.913372 0.197239 -0.234199
C 7.254324 -0.204559 -0.828765
C 7.776205 0.807472 -1.863644
H 0.692423 0.451027 -0.188921
H -0.195588 0.648376 2.136187
H -0.900331 -0.985231 2.024905
H 1.568826 -1.575413 1.795195
H 0.825051 -1.837485 -1.264654
H -0.241807 -2.499265 0.012598
H -0.868148 -1.284499 -1.143150
H 2.923971 -0.135402 -0.428366
H 3.124634 -1.877546 -0.073852
H -3.096942 -1.304257 1.023562
H 4.172790 -1.202160 2.192828
H 4.095120 0.513682 1.620951
H -0.999835 2.448211 0.434168
H -3.037670 3.419605 -0.647460
H -5.117081 2.031551 -0.897298
H 7.143528 -1.213848 -1.268312
H 7.969779 -0.322818 0.008248
H 7.887213 1.809374 -1.415497
H 8.758154 0.485579 -2.252876
H 7.078211 0.902770 -2.713086


