%chk=000003572.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003572

0 1
 S    8.770400      0.2963000     -9.4800003E-02
 F    9.940700     -0.6854000     -0.5308000    
 O    8.710600       1.306900      -1.133700    
 O    9.053000      0.6404000       1.285800    
 C   -1.635100      0.2397000      0.2171000    
 C  -0.3654000     -0.6109000      0.1051000    
 C   -2.956900     -0.5059000      7.6000001E-03
 C   0.9234000      0.2045000      0.2356000    
 C   -4.192300      0.3806000      0.1858000    
 C    2.192200     -0.6387000      6.5499999E-02
 C   -5.479600     -0.4158000     -4.4100001E-02
 C    3.480700      0.1733000      0.2219000    
 C   -6.752700      0.4251000      9.9600002E-02
 C    4.749400     -0.6559000     -6.8000001E-03
 C   -8.038300     -0.3795000     -0.1098000    
 C    6.035400      0.1723000      7.3299997E-02
 C   -9.308100      0.4750000     -3.7000000E-02
 C    7.290300     -0.6618000     -0.1493000    
 C   -10.59300     -0.3196000     -0.2744000    
 C   -11.82490      0.5593000     -0.1167000    
 H   -1.578600       1.055700     -0.5148000    
 H   -1.649900      0.7138000       1.206800    
 H  -0.3676000      -1.125000     -0.8639000    
 H  -0.3844000      -1.389800      0.8769000    
 H   -2.962400     -0.9421000     -0.9989000    
 H   -3.007800      -1.342600      0.7153000    
 H   0.9229000       1.004200     -0.5152000    
 H   0.9420000      0.6919000       1.218100    
 H   -4.147700       1.218700     -0.5197000    
 H   -4.198400      0.8065000       1.196200    
 H    2.188200      -1.451600      0.8019000    
 H    2.178800      -1.108300     -0.9258000    
 H   -5.520000      -1.249200      0.6683000    
 H   -5.457000     -0.8584000      -1.047700    
 H    3.512800      0.6145000       1.225600    
 H    3.465900       1.007200     -0.4908000    
 H   -6.773400      0.8823000       1.096500    
 H   -6.719700       1.247600     -0.6255000    
 H    4.693700      -1.134300     -0.9924000    
 H    4.790000      -1.462300      0.7357000    
 H   -7.997300     -0.8731000      -1.088700    
 H   -8.093200      -1.174700      0.6437000    
 H    6.092400      0.6617000       1.053400    
 H    5.991400      0.9767000     -0.6712000    
 H   -9.242000       1.281600     -0.7777000    
 H   -9.354900      0.9547000      0.9487000    
 H    7.260600      -1.134900      -1.136100    
 H    7.381700      -1.444800      0.6098000    
 H   -10.58060     -0.7529000      -1.280900    
 H   -10.65170      -1.151200      0.4372000    
 H   -11.88150      0.9786000      0.8930000    
 H   -12.73260     -2.6200000E-02 -0.2927000    
 H   -11.81010       1.387100     -0.8327000    


%chk=000003572-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003572

0 1
S 8.940190 0.304499 0.249951
F 10.067452 -1.075709 -0.320355
O 9.143376 1.539003 -0.758410
O 9.161436 0.480780 1.831702
C -1.638102 0.293401 0.090966
C -0.363062 -0.563091 -0.078387
C -2.945838 -0.518488 -0.045651
C 0.941394 0.237909 0.132780
C -4.218355 0.354113 0.041820
C 2.218064 -0.598880 -0.108232
C -5.528670 -0.462301 -0.026949
C 3.517986 0.194395 0.153824
C -6.799354 0.416472 0.009337
C 4.793056 -0.633814 -0.129241
C -8.111255 -0.399926 -0.022665
C 6.083695 0.175639 0.173450
C -9.381063 0.480792 -0.009935
C 7.313068 -0.673356 -0.137994
C -10.693768 -0.335609 -0.028327
C -11.956316 0.553325 -0.022335
H -1.632365 1.108707 -0.662691
H -1.618847 0.789425 1.084043
H -0.358488 -1.013409 -1.093169
H -0.392179 -1.411273 0.637498
H -2.941954 -1.062421 -1.013573
H -2.978437 -1.295461 0.746751
H 0.946245 1.116208 -0.546303
H 0.956849 0.644039 1.165749
H -4.207158 1.098973 -0.781392
H -4.200105 0.936535 0.986949
H 2.197124 -1.496631 0.544296
H 2.217314 -0.972423 -1.153480
H -5.556103 -1.181606 0.818360
H -5.532743 -1.073207 -0.954101
H 3.530157 0.540653 1.207679
H 3.525691 1.106999 -0.476924
H -6.783256 1.046984 0.923130
H -6.783506 1.117888 -0.851160
H 4.793503 -0.956986 -1.189912
H 4.778300 -1.555660 0.486788
H -8.120998 -1.043118 -0.927726
H -8.134686 -1.089140 0.847550
H 6.085055 0.476844 1.238292
H 6.091779 1.098214 -0.437386
H -9.363476 1.163247 -0.885606
H -9.368517 1.131228 0.889891
H 7.444053 -0.922185 -1.203115
H 7.429247 -1.567916 0.494440
H -10.703337 -0.988683 -0.925016
H -10.712496 -1.013744 0.849380
H -11.984392 1.194725 0.878911
H -12.880790 -0.053028 -0.034705
H -11.976016 1.218367 -0.906496


