%chk=000004288.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004288

0 1
 S   -5.378500      0.4407000     -0.4581000    
 F    3.589100       2.464000      0.8988000    
 F    3.274900      -2.158800     -0.1352000    
 O   0.6990000      -2.114000      0.7788000    
 O   -6.054400     -0.7709000     -0.9004000    
 O   -5.934400       1.219500      0.6396000    
 N    1.131400      0.1115000       1.265300    
 N   -5.155900       1.470300      -1.803400    
 C    2.528200     -5.7399999E-02   1.595400    
 C   -1.081500     -0.6055000      0.5498000    
 C   -3.724200      3.8100000E-02 -7.0200004E-02
 C    3.416300      0.1491000      0.4026000    
 C   0.2961000     -0.9411000      0.8732000    
 C   -1.800800      -1.398000     -0.3446000    
 C   -1.683600      0.5088000       1.134400    
 C   -3.122100      -1.076100     -0.6546000    
 C   -3.005000      0.8305000      0.8244000    
 C    3.903300       1.419900      0.1195000    
 C    3.743300     -0.9326000     -0.4067000    
 C    4.728700       1.611600     -0.9885000    
 C    4.568700     -0.7409000      -1.514600    
 C    5.061500      0.5312000      -1.805500    
 H    2.685400      -1.054400       2.023600    
 H    2.767800      0.6628000       2.385800    
 H   0.7853000       1.065100       1.256800    
 H   -1.348100      -2.266800     -0.8154000    
 H   -1.170300       1.135100       1.858000    
 H   -3.661100      -1.702700      -1.359600    
 H   -3.454400       1.702500       1.291400    
 H    5.112100       2.602200      -1.214700    
 H    4.827600      -1.582200      -2.150600    
 H    5.704200      0.6805000      -2.668200    
 H   -5.427400       1.112800      -2.727400    
 H   -5.344000       2.471900      -1.673500    


%chk=000004288-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004288

0 1
S -5.546547 0.737097 -0.370122
F 2.728668 2.181682 0.572214
F 4.463363 -2.290697 0.046653
O 0.481217 -2.372391 0.780899
O -6.452633 -0.603482 -0.549504
O -5.911983 1.944625 0.660317
N 1.184788 -0.180627 1.131580
N -5.406144 1.504512 -2.038220
C 2.578222 -0.558389 1.412410
C -1.174339 -0.609880 0.561078
C -3.778301 0.192429 -0.004928
C 3.548608 -0.076246 0.340609
C 0.220016 -1.130225 0.833528
C -2.067342 -1.495544 -0.094945
C -1.624476 0.677205 0.956407
C -3.387132 -1.099226 -0.390778
C -2.943486 1.092563 0.673244
C 3.617745 1.273602 -0.064141
C 4.457771 -0.932197 -0.316957
C 4.492163 1.773871 -1.038570
C 5.364175 -0.505790 -1.303815
C 5.373813 0.860239 -1.662117
H 2.605255 -1.657846 1.474632
H 2.878357 -0.144992 2.394305
H 0.973282 0.816012 1.071132
H -1.702793 -2.494581 -0.352946
H -0.975503 1.358584 1.517456
H -4.096670 -1.773784 -0.879785
H -3.322814 2.068110 0.992902
H 4.481374 2.836207 -1.294743
H 6.036949 -1.229439 -1.771075
H 6.069491 1.215471 -2.427812
H -5.989457 0.956889 -2.692693
H -5.698435 2.492936 -1.960017


