%chk=000023734.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023734

0 1
 S   -7.037000       1.266500     -6.9600001E-02
 S   -6.187800      -1.608400     -7.1000002E-02
 O   -4.493300      0.4663000     -1.5400000E-02
 C    1.705100     -0.4243000      8.7800004E-02
 C    3.003900      0.3864000      0.1159000    
 C   0.4456000      0.4446000      7.5300001E-02
 C    4.263700     -0.4801000      5.3500000E-02
 C  -0.8207000     -0.4157000      7.8199998E-02
 C    5.527200      0.3825000      1.0900000E-02
 C   -2.082100      0.4520000      3.5599999E-02
 C    6.785800     -0.4791000     -9.0099998E-02
 C   -3.355800     -0.3840000      4.4000000E-03
 C    8.040900      0.3754000     -0.1664000    
 C   -5.795500      1.7999999E-02 -4.9199998E-02
 H    1.681400      -1.088200      0.9609000    
 H    1.704300      -1.069100     -0.7999000    
 H    3.004400       1.082400     -0.7324000    
 H    3.027400      0.9979000       1.026300    
 H   0.4545000       1.087700     -0.8129000    
 H   0.4453000       1.103000      0.9522000    
 H    4.295900      -1.144700      0.9250000    
 H    4.224200      -1.117000     -0.8385000    
 H  -0.8380000      -1.045100      0.9762000    
 H  -0.8103000      -1.087500     -0.7887000    
 H    5.578000       1.006100      0.9116000    
 H    5.479100       1.061100     -0.8496000    
 H   -2.109100       1.120600      0.9051000    
 H   -2.061100       1.107300     -0.8443000    
 H    6.731400      -1.115900     -0.9808000    
 H    6.853100      -1.142800      0.7797000    
 H   -3.351200      -1.012900     -0.8932000    
 H   -3.390200      -1.020400      0.8961000    
 H    8.142500       1.003600      0.7243000    
 H    8.019400       1.026800      -1.046000    
 H    8.928800     -0.2607000     -0.2365000    
 H   -8.094000      0.4417000     -0.1008000    


%chk=000023734-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023734

0 1
S -7.010996 1.383297 0.064276
S -6.258578 -1.662866 0.035693
O -4.580982 0.505316 0.040535
C 1.705910 -0.443284 -0.002642
C 3.000267 0.400897 -0.005932
C 0.420059 0.413301 0.006850
C 4.287580 -0.454082 -0.014524
C -0.872980 -0.432962 0.010350
C 5.582509 0.389156 -0.016731
C -2.152377 0.437539 0.021853
C 6.870100 -0.466333 -0.024887
C -3.410026 -0.428607 0.024984
C 8.158600 0.384432 -0.026724
C -5.842925 -0.029940 0.045623
H 1.707877 -1.112667 0.882981
H 1.699150 -1.106269 -0.893070
H 2.999369 1.070072 -0.891768
H 3.007476 1.064528 0.884020
H 0.418234 1.082149 -0.878779
H 0.427044 1.075704 0.897272
H 4.288556 -1.124042 0.870857
H 4.281165 -1.117259 -0.904993
H -0.868500 -1.101845 0.895858
H -0.878546 -1.093872 -0.881140
H 5.590757 1.052743 0.873415
H 5.583735 1.058887 -0.902310
H -2.155150 1.090479 0.915230
H -2.165266 1.099374 -0.864857
H 6.861018 -1.128770 -0.914614
H 6.867896 -1.135434 0.859875
H -3.495239 -1.064084 -0.876049
H -3.481737 -1.076720 0.918171
H 8.205959 1.032882 0.868590
H 8.198455 1.040342 -0.916959
H 9.064284 -0.249612 -0.033189
H -8.136898 0.581548 0.066434


