%chk=000178992.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178992

0 1
 F   -1.056000      -1.321100      -1.483200    
 O    3.139600     -7.3500000E-02  -1.798300    
 O  -0.8719000       1.694500       1.496800    
 N  -0.8280000       1.512400     -0.8159000    
 N    2.571400       1.151000      -1.468800    
 C   -2.227900       1.201700     -0.9861000    
 C    1.234400       2.061400      0.3438000    
 C   -2.633000     -6.8599999E-02 -0.2269000    
 C  -0.2602000       1.735800      0.4310000    
 C    1.786500       2.415400       1.739100    
 C   -2.482100       1.023100      -2.494400    
 C   -3.035400       2.408200     -0.4728000    
 C    1.972400      0.9190000     -0.3191000    
 C    2.091400     -0.3746000      0.1577000    
 C    3.268400       2.768700       1.720400    
 C   -2.004800      -1.249800     -0.5393000    
 C   -3.609200      3.0400001E-02  0.7350000    
 C    2.851500     -0.9818000     -0.8266000    
 C    1.678800      -1.131700       1.264100    
 C   -2.375400      -2.402900      0.1526000    
 C   -3.979800      -1.122800       1.427000    
 C    3.246100      -2.316200     -0.8014000    
 C   -3.362900      -2.339400       1.135700    
 C    2.058600      -2.480200       1.322300    
 C    2.827600      -3.059100      0.3074000    
 H    1.318600       2.959600     -0.2854000    
 H  -0.2468000       1.605100      -1.644400    
 H    1.228900       3.273100       2.136800    
 H    1.628600       1.595600       2.449200    
 H   -2.282300       1.955300      -3.037200    
 H   -1.843000      0.2590000      -2.949000    
 H   -3.524100      0.7437000      -2.690200    
 H   -2.713200       3.319300     -0.9960000    
 H   -2.912200       2.629400      0.5923000    
 H   -4.106700       2.306800     -0.6886000    
 H    3.584600       3.104500       2.713400    
 H    3.469800       3.577800       1.011200    
 H    3.888200       1.908300       1.451100    
 H   -4.136100      0.9332000       1.013300    
 H    1.075400     -0.7033000       2.057700    
 H   -1.894100      -3.349700     -7.3899999E-02
 H   -4.749400      -1.075000       2.192000    
 H    3.841600      -2.755900      -1.592000    
 H   -3.651400      -3.237200       1.674400    
 H    1.747300      -3.085700       2.169800    
 H    3.105300      -4.107800      0.3811000    


%chk=000178992-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178992

0 1
F -0.803293 -0.843395 -1.833001
O 3.132601 -0.592958 -1.634407
O -0.704939 1.721192 1.561548
N -0.900070 1.787364 -0.767416
N 2.637969 0.800154 -1.448705
C -2.348435 1.422236 -0.866669
C 1.338247 2.092493 0.205945
C -2.554647 -0.019035 -0.340455
C -0.187072 1.855747 0.410907
C 1.999470 2.630301 1.504171
C -2.727053 1.485801 -2.373452
C -3.189794 2.469368 -0.096604
C 1.969054 0.805056 -0.277348
C 1.964016 -0.501124 0.357544
C 3.481164 3.007116 1.304811
C -1.790976 -1.099452 -0.842827
C -3.515907 -0.355444 0.645130
C 2.702696 -1.333827 -0.524178
C 1.403008 -1.045405 1.541008
C -1.933001 -2.430331 -0.427942
C -3.697304 -1.685721 1.085760
C 2.938658 -2.699014 -0.284353
C -2.906711 -2.727435 0.551414
C 1.627427 -2.411360 1.801543
C 2.386402 -3.222158 0.904811
H 1.475618 2.844205 -0.597141
H -0.366310 1.774505 -1.641020
H 1.420912 3.512242 1.836706
H 1.893523 1.877059 2.304763
H -2.583530 2.512855 -2.756063
H -2.119861 0.789664 -2.976786
H -3.788331 1.215028 -2.501994
H -2.969553 3.470921 -0.504653
H -2.942397 2.469037 0.976348
H -4.269055 2.276926 -0.229794
H 3.912611 3.393088 2.245925
H 3.597095 3.790128 0.532116
H 4.083258 2.136620 0.987775
H -4.121200 0.438551 1.089961
H 0.798493 -0.427569 2.212251
H -1.291442 -3.202567 -0.862327
H -4.448226 -1.904587 1.852087
H 3.513880 -3.315168 -0.980105
H -3.038699 -3.759498 0.892338
H 1.208465 -2.865293 2.705560
H 2.542338 -4.280310 1.142516


