%chk=000116513.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116513

0 1
 Cl   4.373000     -0.5463000       2.029300    
 S    3.233600      -1.375300     -0.8823000    
 F   -5.285800      0.6574000       1.487100    
 F   -5.647200       1.689600     -0.4000000    
 F   -6.389700     -0.3380000     -0.1063000    
 O    4.578000      -1.855400     -0.5945000    
 O    2.761400      -1.377700      -2.259400    
 O   -3.918600     -0.2800000      -1.607000    
 N    2.127300      -2.240700      0.1130000    
 N   -3.102800     -0.2648000      0.6042000    
 C    3.112400      0.2578000     -0.2582000    
 C   0.7872000      -1.734300      0.2388000    
 C    2.499700       1.221000      -1.059800    
 C    2.380900       2.534200     -0.6045000    
 C    3.606400      0.6077000      0.9984000    
 C   0.3022000      -1.378200       1.491400    
 C  -8.2000000E-03  -1.606800     -0.8935000    
 C   -1.802800     -0.7560000      0.4821000    
 C    2.874700       2.884200      0.6520000    
 C    3.487400       1.920900       1.453600    
 C  -0.9978000     -0.8873000       1.613600    
 C   -1.308000      -1.115800     -0.7715000    
 C    1.725800       3.564300      -1.461100    
 C   -4.050600     -6.4300001E-02 -0.4071000    
 C   -5.338500      0.4838000      0.1418000    
 H    2.517500      -2.644100      0.9748000    
 H    2.105900      0.9721000      -2.041300    
 H   0.9219000      -1.475500       2.378600    
 H   0.3429000      -1.907700      -1.875300    
 H    2.790100       3.903900       1.018000    
 H    3.867000       2.210500       2.430200    
 H   -1.369900     -0.6102000       2.596700    
 H   -1.873400      -1.049100      -1.690500    
 H   0.8710000       3.139000      -1.998000    
 H    1.345100       4.399200     -0.8629000    
 H    2.441500       3.957400      -2.189900    
 H   -3.389500     -2.5500000E-02   1.551100    


%chk=000116513-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116513

0 1
Cl 4.003188 -0.550472 2.289100
S 3.225290 -1.326472 -0.949157
F -5.575430 0.443309 1.744491
F -6.006215 1.483755 -0.232211
F -6.715804 -0.640471 0.101229
O 4.667019 -2.020134 -0.714138
O 2.592118 -1.176666 -2.435311
O -4.254648 -0.501672 -1.518135
N 1.961074 -2.409991 0.083694
N -3.341492 -0.474126 0.671028
C 3.195809 0.459156 -0.228884
C 0.657709 -1.872793 0.229200
C 2.810019 1.465897 -1.128422
C 2.792754 2.821461 -0.709920
C 3.551275 0.753458 1.096445
C 0.151124 -1.461968 1.496880
C -0.187083 -1.790996 -0.914828
C -2.010982 -0.941338 0.471375
C 3.163399 3.111208 0.628158
C 3.538113 2.092042 1.532620
C -1.177188 -1.026272 1.618873
C -1.505497 -1.319109 -0.803584
C 2.409747 3.921611 -1.680800
C -4.323313 -0.291297 -0.279779
C -5.654075 0.246373 0.325607
H 2.468869 -2.560848 0.975594
H 2.528725 1.177231 -2.148293
H 0.797051 -1.500378 2.381975
H 0.204702 -2.114520 -1.883208
H 3.156714 4.150147 0.976140
H 3.812875 2.330411 2.564393
H -1.563974 -0.735810 2.603749
H -2.148565 -1.258607 -1.683259
H 1.560889 3.620110 -2.318811
H 2.130304 4.848904 -1.152657
H 3.253958 4.163186 -2.354303
H -3.598359 -0.244319 1.636750


