%chk=000110558.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000110558

0 1
 S   0.4628000     -0.9378000      0.6434000    
 F  -0.7252000     -0.3031000      -1.572900    
 F  -0.8683000      -2.396500      -1.016400    
 F   -3.189500      -1.251500     -0.8579000    
 F   -2.445900      -1.808000       1.106000    
 F   -3.912500      0.3856000       1.114200    
 F   -1.855600      0.7820000       1.684400    
 F   -3.463800       1.385500      -1.389300    
 F   -1.378300       1.787900     -0.8881000    
 F   -2.969700       2.758500      0.2315000    
 O   0.5153000      0.4467000       1.070100    
 O   0.3859000      -2.011700       1.615200    
 N    1.791100      -1.254200     -0.3861000    
 N    4.652200      0.7953000      0.4771000    
 C  -0.8923000      -1.130200     -0.5081000    
 C   -2.271600     -0.9109000      9.4200000E-02
 C    2.330400     -0.1656000      -1.220600    
 C   -2.640900      0.4657000      0.6246000    
 C    3.808300     -0.4066000      -1.519100    
 C    4.708400     -0.4493000     -0.2805000    
 C   -2.607600       1.601400     -0.3681000    
 C    5.102700       1.919900     -0.3449000    
 C    5.464200      0.6969000       1.691300    
 H    1.775100     -0.1515000      -2.164700    
 H    2.197400      0.8080000     -0.7419000    
 H    4.162700      0.3311000      -2.247400    
 H    3.904200      -1.376800      -2.025700    
 H    1.855900      -2.192700     -0.8006000    
 H    5.736100     -0.6717000     -0.5974000    
 H    4.391800      -1.285100      0.3560000    
 H    6.091000       1.745400     -0.7859000    
 H    5.164700       2.832100      0.2610000    
 H    4.392100       2.156200      -1.142500    
 H    6.523600      0.5260000       1.467800    
 H    5.108500     -0.1219000       2.326700    
 H    5.379800       1.612800       2.286700    


%chk=000110558-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000110558

0 1
S 0.664270 -1.089915 0.570424
F -0.650631 0.626671 -1.340590
F -0.724786 -1.599963 -1.831811
F -3.275240 -0.499183 -1.422885
F -2.607110 -2.075463 0.091184
F -4.187045 -0.158646 1.151066
F -2.058098 -0.132758 1.995800
F -3.358848 2.132943 -0.546884
F -1.487218 2.221707 0.739650
F -3.530868 2.354733 1.703621
O 1.102525 0.343436 1.169018
O 0.207199 -2.349751 1.470589
N 1.977177 -1.662389 -0.500537
N 4.677024 1.016788 -0.013193
C -0.932049 -0.642908 -0.817407
C -2.394023 -0.740976 -0.325433
C 2.654067 -0.725788 -1.424071
C -2.847590 0.184934 0.865838
C 4.176334 -0.998737 -1.406731
C 4.812659 -0.455334 -0.106692
C -2.799137 1.747502 0.677910
C 5.719512 1.748144 -0.759110
C 4.509676 1.518978 1.368015
H 2.231487 -0.802886 -2.444386
H 2.517276 0.308087 -1.050064
H 4.617309 -0.500818 -2.292422
H 4.384719 -2.081964 -1.507173
H 1.780979 -2.622460 -0.817973
H 5.879786 -0.781619 -0.048421
H 4.287893 -0.911731 0.752255
H 6.740767 1.626166 -0.316992
H 5.479806 2.826351 -0.772514
H 5.760297 1.400782 -1.806780
H 5.408506 1.354189 2.012822
H 3.639057 1.028882 1.835641
H 4.307316 2.604898 1.340333


