%chk=000055885.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055885

0 1
 F    5.490500     -0.4468000      0.7075000    
 O   0.2039000      -2.411000      -2.350200    
 O    1.618900      -1.190600     -0.2911000    
 O   -4.781000       2.022000      -1.048100    
 O    3.181200      -1.719200       1.314700    
 N   -1.783000      -1.404400      0.6019000    
 N   -5.154800      7.8400001E-02  0.1751000    
 N   -6.697400       1.788000      0.1941000    
 C   -2.774000     -0.3338000      0.7875000    
 C   -3.943200     -0.6134000     -0.1758000    
 C   -1.285500      -1.403500     -0.7619000    
 C   -3.234900     -0.3692000       2.251100    
 C   -2.104200       1.013400      0.4796000    
 C  -0.2569000      -2.511600     -0.9998000    
 C   0.9492000      -2.427500     -6.6900000E-02
 C   -5.478900       1.348600     -0.2918000    
 C    2.723400     -0.9648000      0.4704000    
 C    3.325300      0.3524000      0.1430000    
 C    4.699600      0.5479000      0.2800000    
 C    2.513600       1.395400     -0.3031000    
 C    5.262100       1.786500     -2.9200001E-02
 C    3.076100       2.633800     -0.6121000    
 C    4.450200       2.829400     -0.4751000    
 H   -4.210300      -1.677700     -0.1687000    
 H   -3.705000     -0.3362000      -1.208800    
 H   -2.198000      -2.310200      0.8190000    
 H  -0.8027000     -0.4593000      -1.033700    
 H   -2.073800      -1.571700      -1.503200    
 H   -3.920900      0.4530000       2.483600    
 H   -2.382200     -0.2748000       2.934600    
 H   -3.745600      -1.309900       2.488300    
 H   -2.713600       1.840100      0.8642000    
 H   -1.125300       1.098400      0.9674000    
 H   -1.975900       1.203800     -0.5910000    
 H  -0.7328000      -3.492500     -0.8889000    
 H   -5.807500     -0.3833000      0.8012000    
 H   0.6495000      -2.512100      0.9835000    
 H    1.644400      -3.241200     -0.3064000    
 H   0.6799000      -1.567500      -2.439600    
 H   -7.066800       2.698100     -5.9799999E-02
 H   -7.258800       1.218400      0.8181000    
 H    1.438400       1.275500     -0.4077000    
 H    6.332000       1.938500      7.7500001E-02
 H    2.443800       3.447000     -0.9567000    
 H    4.888100       3.793900     -0.7151000    


%chk=000055885-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000055885

0 1
F 4.790704 0.973836 0.473261
O 0.661366 -3.276547 -1.993233
O 1.216925 -1.160219 -0.163430
O -1.993727 2.135627 -0.786946
O 2.974310 -1.025598 1.364092
N -2.284362 -2.380600 0.218977
N -3.905105 1.108534 0.103093
N -3.620734 3.443565 0.248715
C -2.848298 -1.136707 0.821790
C -3.498973 -0.243163 -0.302661
C -1.353956 -2.309377 -0.927298
C -3.934801 -1.576807 1.831840
C -1.740186 -0.358761 1.568718
C -0.050791 -3.128161 -0.711653
C 0.873540 -2.523219 0.346658
C -3.110845 2.217888 -0.181711
C 2.280754 -0.491248 0.471412
C 2.407152 0.898759 -0.059132
C 3.634636 1.606599 -0.007112
C 1.280467 1.589192 -0.587457
C 3.765434 2.932522 -0.451405
C 1.383352 2.924608 -1.025802
C 2.626825 3.596285 -0.961065
H -4.378083 -0.780372 -0.712338
H -2.772463 -0.106246 -1.120713
H -2.988485 -3.119083 0.118182
H -1.061145 -1.260931 -1.115726
H -1.809424 -2.688958 -1.865072
H -4.386777 -0.698956 2.328837
H -3.492749 -2.219528 2.613457
H -4.745414 -2.144289 1.332475
H -2.139017 0.571128 2.010759
H -1.334062 -0.988075 2.380328
H -0.915644 -0.080936 0.893065
H -0.306070 -4.159084 -0.409392
H -4.770443 1.221876 0.631310
H 0.362783 -2.424769 1.319613
H 1.803462 -3.104578 0.462726
H 1.072124 -2.398084 -2.206400
H -3.053805 4.266835 0.064667
H -4.534721 3.558979 0.680735
H 0.308788 1.093052 -0.635265
H 4.742896 3.420308 -0.395789
H 0.485660 3.422361 -1.403403
H 2.716000 4.632643 -1.304105


