%chk=000106193.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106193

0 1
 S    1.120500      0.1586000     -0.8017000    
 P    6.427500      0.6707000      5.8899999E-02
 F  -0.5173000      -1.759200     -0.1995000    
 F  -0.2653000     -0.2501000       1.352600    
 F   -1.442100       1.632400     -0.3153000    
 F   -1.752800      8.6999997E-02  -1.822200    
 F   -2.745100      3.0200001E-02   1.555700    
 F   -3.058700      -1.479100      1.8900000E-02
 F   -4.336900      0.2957000      -1.559600    
 F   -4.049900       1.883400     -9.8999999E-02
 F   -6.535400      0.7504000     -2.1000000E-02
 F   -5.660300      -1.214900      0.2863000    
 F   -5.392300      0.3384000       1.793500    
 O    1.325300       1.541500     -0.4130000    
 O    1.030700     -0.1975000      -2.205600    
 O    5.064000     -0.1373000      0.3782000    
 O    5.890200       1.989000     -0.7081000    
 O    6.884400       1.240200       1.501900    
 O    7.471800     -0.1122000     -0.6818000    
 N    2.324100     -0.8122000     -5.7100002E-02
 C  -0.3695000     -0.4248000      8.9999996E-03
 C   -1.616300      0.2979000     -0.4878000    
 C   -2.894700     -0.1395000      0.2152000    
 C    2.850700     -0.4014000       1.267100    
 C    2.233000      -2.286100     -0.1934000    
 C   -4.183200      0.5374000     -0.2262000    
 C    4.027000      0.5388000       1.077800    
 C   -5.453500      0.1098000      0.4651000    
 C    3.624000      -2.887100     -0.1887000    
 H    2.066300      0.1044000       1.839800    
 H    3.149700      -1.261100       1.873900    
 H    1.632400      -2.708100      0.6195000    
 H    1.750000      -2.543500      -1.141800    
 H    4.399600      0.8537000       2.057700    
 H    3.736100       1.431300      0.5177000    
 H    4.253800      -2.429300     -0.9589000    
 H    4.134900      -2.785800      0.7723000    
 H    3.562900      -3.959200     -0.4048000    
 H    6.541900       2.611500      -1.095200    
 H    7.736500       1.720700       1.574200    


%chk=000106193-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106193

0 1
S 1.289626 -0.515193 -1.599760
P 6.323998 0.937201 0.872674
F -1.274721 -1.720144 -2.114552
F -0.529140 -2.035461 0.024447
F -0.836415 0.782868 0.480681
F -1.850188 0.944500 -1.584257
F -2.718852 -0.768041 1.485032
F -3.549200 -1.367180 -0.556024
F -4.640406 1.012660 -1.009333
F -3.367243 2.072922 0.570421
F -6.187480 1.595375 1.104394
F -5.719854 -0.623994 1.219391
F -4.684904 0.840340 2.619521
O 1.365499 1.101577 -1.604168
O 1.524658 -1.415083 -2.921311
O 4.843245 0.102621 1.023134
O 6.274102 1.801678 -0.628288
O 6.008655 2.250467 1.926753
O 7.586471 0.014988 1.093620
N 2.407965 -1.095300 -0.311009
C -0.727678 -1.088056 -1.005294
C -1.598627 0.083483 -0.496243
C -2.976640 -0.300261 0.173943
C 2.456489 -0.248007 0.904570
C 2.651686 -2.563606 -0.250136
C -4.031959 0.866481 0.252936
C 3.548671 0.822971 0.864115
C -5.171154 0.661354 1.321876
C 4.159161 -2.866228 -0.162407
H 1.489642 0.268590 1.069556
H 2.625468 -0.916439 1.768447
H 2.107238 -2.995562 0.613209
H 2.239134 -3.010282 -1.172991
H 3.430003 1.522764 1.711237
H 3.532435 1.378560 -0.089362
H 4.676000 -2.521575 -1.073329
H 4.625085 -2.366809 0.702149
H 4.301552 -3.958366 -0.064535
H 6.717341 1.341266 -1.386072
H 6.644338 3.007520 1.881560


