%chk=000147839.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147839

0 1
 S    3.714100      -2.382600     -0.2146000    
 F    4.458400     -0.3461000       1.250900    
 O    1.565800     -0.2139000     -0.8686000    
 O   0.3944000       2.620700       1.005600    
 O    2.620600       2.629600     -0.5529000    
 N  -0.6799000     -0.1607000     -0.1044000    
 N   -1.907300      -1.906600      0.5465000    
 N   -2.451100       1.396100     -0.6883000    
 N   -4.654500      0.4126000     -0.3226000    
 N   -4.946300      -1.811700      0.5108000    
 C    1.062000       1.393100      0.7964000    
 C    2.513400       1.567400      0.3948000    
 C   0.5044000      0.6413000     -0.4026000    
 C    2.816800      0.2482000     -0.3086000    
 C    3.343200     -0.8216000      0.6379000    
 C   -1.985700      0.2179000     -0.2472000    
 C  -0.6862000      -1.445300      0.3748000    
 C   -2.729400     -0.8775000      0.1617000    
 C   -4.114100     -0.7509000      0.1133000    
 C    4.963600      -1.809300      -1.392100    
 C   -3.801900       1.399200     -0.6910000    
 H   0.9889000      0.7938000       1.711300    
 H    3.169300       1.804800       1.237000    
 H   0.2327000       1.313600      -1.225700    
 H    3.512200      0.4286000      -1.133800    
 H    2.610800      -1.053100       1.417300    
 H   0.5098000       3.165500      0.2086000    
 H    3.556000       2.695300     -0.8108000    
 H   0.2213000      -1.993900      0.5860000    
 H    4.499100      -1.264300      -2.217100    
 H    5.475500      -2.679500      -1.812500    
 H    5.708100      -1.180500     -0.8972000    
 H   -4.268800       2.316200      -1.034400    
 H   -4.545500      -2.681000      0.8363000    
 H   -5.949500      -1.695500      0.4664000    


%chk=000147839-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000147839

0 1
S 4.234439 -2.239340 -0.434485
F 5.220397 0.214324 0.369869
O 1.614014 -0.447437 -0.113962
O 0.541151 2.745799 1.399653
O 2.813159 2.784649 0.116371
N -0.677292 -0.099759 0.426861
N -2.212118 -1.458711 1.459983
N -2.060383 0.693294 -1.482515
N -4.335249 -0.243637 -1.422991
N -5.074336 -1.721960 0.266444
C 1.161008 1.453317 1.258049
C 2.668965 1.530646 0.864764
C 0.557199 0.578499 0.119704
C 2.898005 0.286595 -0.050022
C 3.998416 -0.643918 0.455700
C -1.848590 -0.024185 -0.344910
C -0.958215 -0.979966 1.490362
C -2.782763 -0.861852 0.316448
C -4.078417 -0.953246 -0.271896
C 3.902051 -1.740172 -2.222480
C -3.333203 0.522024 -1.954198
H 1.042560 0.930714 2.222802
H 3.329930 1.530369 1.749628
H 0.380971 1.185046 -0.790867
H 3.163538 0.658704 -1.060155
H 3.887092 -0.910302 1.520496
H 1.039772 3.371071 0.802777
H 3.766438 3.032055 0.042465
H -0.209390 -1.253159 2.229242
H 2.853153 -1.428890 -2.331892
H 4.084992 -2.650522 -2.813588
H 4.601081 -0.950978 -2.536742
H -3.585620 1.064444 -2.870018
H -4.902172 -2.253922 1.116770
H -5.980386 -1.749694 -0.196466


