%chk=000100809.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100809

0 1
 Cl   4.203500      -1.977800      -1.662800    
 S   -1.093400       2.286600     -0.3257000    
 F    1.295000      -1.580200       2.586900    
 F    1.184900      0.5509000       2.974300    
 F  -0.4414000     -0.4471000       1.931200    
 F   -3.272400      -3.157000     -0.6906000    
 O   -1.990100       3.041300      0.5298000    
 O  -0.8260000       2.748000      -1.674400    
 N   0.3870000       2.021300      0.5123000    
 C    1.301600       1.048300      1.2000001E-03
 C    1.573700     -0.1207000      0.7119000    
 C   -1.749400      0.6464000     -0.4358000    
 C    1.926200       1.281000      -1.223900    
 C    2.470500      -1.057000      0.1974000    
 C   0.9183000     -0.3941000       2.026300    
 C   -2.567500      0.1795000      0.5767000    
 C   -1.430700     -0.1340000      -1.532100    
 C    2.822900      0.3446000      -1.738600    
 C    3.095300     -0.8244000      -1.028000    
 C   -3.084800      -1.113000      0.4900000    
 C   -1.948100      -1.426600      -1.618700    
 C   -2.775200      -1.915900     -0.6075000    
 H   0.3403000       2.082600       1.537500    
 H    1.743500       2.193400      -1.784400    
 H    2.688000      -1.970800      0.7453000    
 H   -2.815600      0.7864000       1.441900    
 H  -0.7914000      0.2279000      -2.330900    
 H    3.305500      0.5412000      -2.692600    
 H   -3.727200      -1.495200       1.277900    
 H   -1.707300      -2.052100      -2.473200    


%chk=000100809-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100809

0 1
Cl 4.881121 -1.685124 -1.555704
S -1.112888 2.190944 -0.415813
F 1.909100 -1.562000 2.785825
F 1.293789 0.604923 3.073346
F -0.083669 -0.825699 1.990180
F -4.020186 -3.072368 -0.785959
O -1.943227 3.172943 0.567636
O -0.643452 2.589199 -1.915105
N 0.486463 1.891380 0.565930
C 1.470638 1.011095 0.080345
C 1.937596 -0.120335 0.828830
C -2.026956 0.543749 -0.534803
C 2.061084 1.272098 -1.189608
C 2.989727 -0.926141 0.339327
C 1.298137 -0.479336 2.136133
C -2.902220 0.200543 0.510588
C -1.794280 -0.259015 -1.665238
C 3.077837 0.443621 -1.697348
C 3.539329 -0.640176 -0.920805
C -3.583653 -1.031600 0.422006
C -2.474522 -1.492995 -1.749910
C -3.345260 -1.846435 -0.701702
H 0.234629 1.865731 1.564580
H 1.715526 2.140860 -1.755431
H 3.357514 -1.768235 0.930718
H -3.064015 0.879301 1.353424
H -1.126911 0.080751 -2.462880
H 3.526339 0.655966 -2.671966
H -4.280154 -1.357865 1.198688
H -2.341739 -2.162280 -2.603886


