%chk=000018391.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018391

0 1
 S    2.608000      1.8300001E-02 -0.5242000    
 O   -3.270100      0.3371000      0.2581000    
 C   9.2900001E-02  -1.074900     -3.0099999E-02
 C   0.8370000      7.7299997E-02 -0.2838000    
 C   -1.287400     -0.9878000      0.1516000    
 C   0.2010000       1.316500     -0.3558000    
 C   -1.923400      0.2516000      7.9599999E-02
 C   0.7285000      -2.425600      5.6299999E-02
 C   -1.179300       1.403800     -0.1740000    
 C    3.192900       1.083700      0.8222000    
 H   -1.873200      -1.882200      0.3499000    
 H   0.7556000       2.228700     -0.5612000    
 H    1.214500      -2.685800     -0.8898000    
 H    1.462900      -2.456200      0.8681000    
 H  -7.7000000E-03  -3.210600      0.2629000    
 H   -1.669600       2.371700     -0.2329000    
 H    2.803300      0.7331000       1.781800    
 H    2.885400       2.119900      0.6609000    
 H    4.285100       1.049300      0.8560000    
 H   -3.624000     -0.5536000      0.4234000    


%chk=000018391-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018391

0 1
S 2.545050 0.450329 -0.850374
O -3.422131 0.300348 0.262557
C 0.150400 -0.870507 0.017566
C 0.745457 0.339500 -0.443466
C -1.247647 -0.879688 0.256955
C -0.054334 1.488512 -0.664348
C -2.034486 0.275176 0.038223
C 0.959428 -2.130514 0.261145
C -1.442535 1.469085 -0.430029
C 3.286886 0.551745 0.888953
H -1.720011 -1.806513 0.611476
H 0.424082 2.403831 -1.026814
H 1.797792 -2.201459 -0.453422
H 1.397015 -2.135155 1.278969
H 0.331391 -3.033447 0.169469
H -2.067555 2.349990 -0.600189
H 3.090718 -0.377761 1.444773
H 2.865218 1.416475 1.422941
H 4.372137 0.683171 0.752617
H -3.744477 -0.578818 0.582000


