%chk=000078585.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078585

0 1
 S   0.1310000      6.1099999E-02 -0.7974000    
 F    2.988100      0.6414000       1.656100    
 F    4.728400       1.150500     -0.2564000    
 F    4.024700     -0.7246000      -1.454100    
 N   -2.354000     -0.7810000     -0.3010000    
 N   -1.979600       1.598700     -0.2374000    
 C    2.096500      -1.364900      0.5779000    
 C   0.6224000     -0.9614000      0.6249000    
 C   -1.571200      0.3188000     -0.4057000    
 C    3.034700     -0.1935000      0.5918000    
 C   -3.648700     -0.5477000     -1.7000000E-03
 C   -4.175800      0.7128000      0.1920000    
 C   -4.534800      -1.741800      0.1209000    
 C   -3.285800       1.759000      5.9900001E-02
 C    3.924100      7.2600000E-02 -0.3698000    
 H    2.316800      -1.983300       1.456700    
 H    2.275800      -2.003200     -0.2964000    
 H   9.3999999E-03  -1.869100      0.6420000    
 H   0.4162000     -0.4040000       1.545900    
 H   -5.217800      0.8812000      0.4320000    
 H   -3.976100      -2.666200     -5.9000000E-02
 H   -4.963000      -1.796700       1.126800    
 H   -5.346700      -1.690300     -0.6115000    
 H   -3.608000       2.786000      0.1939000    


%chk=000078585-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078585

0 1
S 0.184067 0.449385 -0.785391
F 2.617267 -0.646679 2.145746
F 4.647907 1.049326 1.228745
F 4.309136 0.392833 -0.930491
N -2.216817 -0.508501 0.155174
N -2.199739 1.671452 -0.947919
C 2.098878 -1.494468 -0.098781
C 0.580485 -1.229891 0.000471
C -1.606316 0.531014 -0.485570
C 2.922843 -0.589922 0.769038
C -3.567408 -0.402727 0.366894
C -4.276881 0.745795 -0.073290
C -4.250256 -1.547599 1.077606
C -3.543802 1.758567 -0.730382
C 3.912124 0.244786 0.388356
H 2.274964 -2.541997 0.219229
H 2.445002 -1.411941 -1.144233
H 0.011260 -1.999266 -0.542695
H 0.234163 -1.206441 1.044173
H -5.353449 0.842254 0.089839
H -3.514755 -2.328586 1.323290
H -4.730191 -1.203371 2.012316
H -5.043420 -1.989067 0.446363
H -4.028463 2.669443 -1.098086


