%chk=000040900.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040900

0 1
 S    3.077800       1.759600     -7.6000001E-03
 S    3.101100      -1.739500      7.8999996E-03
 O   5.9700001E-02   2.306100     -8.1600003E-02
 O   9.0599999E-02  -2.326600      8.3700001E-02
 N  -0.4130000     -1.3500000E-02  6.9999998E-04
 N   -2.491500      -1.215300      1.8200001E-02
 C    1.773500      0.6656000      3.1000001E-03
 C    1.782300     -0.6632000     -2.0000001E-03
 C   0.3711000       1.127500     -1.7000001E-02
 C   0.3861000      -1.144000      1.8500000E-02
 C    4.459700      0.6552000      0.4174000    
 C    4.467200     -0.6170000     -0.4209000    
 C   -1.845600     -2.3200000E-02  7.9999998E-04
 C   -2.501300       1.201900     -1.8100001E-02
 C   -3.891900       1.203500     -1.8800000E-02
 C   -3.842800      -1.174100      1.6799999E-02
 C   -4.583000     -3.0000000E-03 -1.1000000E-03
 H    4.429900      0.4286000       1.489300    
 H    5.384400       1.212700      0.2340000    
 H    4.431600     -0.3910000      -1.492700    
 H    5.399600      -1.162200     -0.2399000    
 H   -2.041900       2.176200     -2.7100001E-02
 H   -4.437700       2.142300     -3.1800002E-02
 H   -4.334000      -2.141400      3.1099999E-02
 H   -5.666700     -2.5800001E-02 -1.0000000E-03


%chk=000040900-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040900

0 1
S 3.164254 1.778961 -0.557813
S 3.145344 -1.775487 0.508835
O -0.008943 2.298038 -0.632813
O -0.012355 -2.175913 0.892009
N -0.443540 0.054290 0.092539
N -2.443270 -1.044079 -0.546388
C 1.800286 0.672150 -0.194005
C 1.794826 -0.634031 0.223633
C 0.388022 1.159022 -0.291199
C 0.376112 -1.076988 0.447081
C 4.570237 0.715655 0.155260
C 4.534304 -0.752620 -0.290623
C -1.874744 0.052284 0.022054
C -2.612694 1.161289 0.504771
C -4.018250 1.116761 0.392471
C -3.803546 -1.079566 -0.620158
C -4.632079 -0.026234 -0.171064
H 4.543745 0.806264 1.252265
H 5.481697 1.205788 -0.227379
H 4.434624 -0.840799 -1.383521
H 5.453282 -1.270385 0.033250
H -2.100071 2.022144 0.939263
H -4.622605 1.957342 0.748533
H -4.229855 -1.983774 -1.068705
H -5.719581 -0.100714 -0.266395


