%chk=000077369.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077369

0 1
 S  -0.9967000      0.2014000      -1.112500    
 S    3.321200       2.337000     -4.9699999E-02
 S   -4.150900      -1.030100      -2.066800    
 P   -2.953900     -0.4694000     -0.6167000    
 O   -3.624500      0.6837000      0.3292000    
 O   -2.786600      -1.628300      0.5249000    
 O   0.8449000       3.171200      0.3369000    
 N    1.200500      0.8406000      0.2629000    
 C    2.286900     -6.0699999E-02  8.8600002E-02
 C  -0.1436000      0.3882000      0.4646000    
 C    3.513500      0.5779000     -9.3800001E-02
 C    1.568000       2.192900      0.2181000    
 C    2.208100      -1.448200      8.8600002E-02
 C    4.682900     -0.1431000     -0.2793000    
 C    3.380800      -2.185000     -9.7400002E-02
 C    4.610100      -1.536800     -0.2801000    
 C   -3.975100       1.944500     -0.2168000    
 C   -2.224100      -2.886800      0.1920000    
 C   -4.569900       2.806900      0.8761000    
 C   -2.191400      -3.755700       1.431200    
 H  -0.1726000     -0.5360000       1.047800    
 H  -0.6845000       1.147400       1.039400    
 H    1.272400      -1.978900      0.2222000    
 H    5.637200      0.3534000     -0.4214000    
 H    3.340200      -3.270900     -0.1019000    
 H    5.512300      -2.124900     -0.4238000    
 H   -3.083600       2.426000     -0.6289000    
 H   -4.707100       1.812600      -1.018400    
 H   -2.829600      -3.372600     -0.5782000    
 H   -1.210700      -2.746400     -0.1943000    
 H   -3.853500       2.941200       1.693300    
 H   -4.851600       3.790000      0.4887000    
 H   -5.456400       2.328500       1.305200    
 H   -1.763000      -4.737100       1.209400    
 H   -1.596800      -3.280500       2.218400    
 H   -3.200700      -3.892700       1.833200    


%chk=000077369-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077369

0 1
S -0.707424 -0.946757 -1.136550
S 2.600222 2.770408 0.163738
S -4.170645 -0.986865 -2.320167
P -2.968845 -0.788466 -0.657612
O -3.092982 0.607335 0.351336
O -3.163300 -1.895443 0.664213
O -0.130618 2.562906 0.673138
N 1.104313 0.558579 0.383478
C 2.406220 0.089572 0.075142
C -0.037999 -0.317486 0.564046
C 3.358565 1.133872 -0.066364
C 0.936053 1.955509 0.450673
C 2.791068 -1.257433 -0.092741
C 4.703733 0.853505 -0.360018
C 4.143477 -1.539866 -0.387196
C 5.093644 -0.498052 -0.516697
C -3.286833 1.945965 -0.302705
C -3.294956 -3.344679 0.330926
C -3.482404 2.936016 0.838537
C -3.521122 -4.057370 1.660643
H 0.239578 -1.197636 1.159792
H -0.859424 0.242703 1.038055
H 2.059274 -2.067506 -0.016810
H 5.433866 1.661278 -0.467913
H 4.455612 -2.580348 -0.523456
H 6.137234 -0.735208 -0.746548
H -2.383526 2.184565 -0.893050
H -4.167614 1.881905 -0.968722
H -4.148526 -3.478260 -0.360393
H -2.366988 -3.685504 -0.169215
H -2.576707 2.980686 1.463574
H -3.663047 3.943360 0.419193
H -4.348514 2.654240 1.460805
H -3.632731 -5.143567 1.486429
H -2.669762 -3.897869 2.343756
H -4.436694 -3.684789 2.149384


