%chk=000174125.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174125

0 1
 S   -3.404400     -0.1417000      0.3306000    
 O   -4.396700      0.9169000      0.4284000    
 O   -3.309700      -1.151700       1.373200    
 N   -3.532700     -0.8932000      -1.212400    
 N   -4.737500      -1.568900      -1.215100    
 C   0.6054000      0.5442000      3.4200002E-02
 C    1.817300     -0.1894000      2.7000001E-03
 C  -0.6293000     -0.1353000      0.1547000    
 C   0.6308000       1.955500     -5.4699998E-02
 C    1.791900      -1.600700      9.1600001E-02
 C   -1.820200      0.6050000      0.1845000    
 C    3.051900      0.4901000     -0.1178000    
 C  -0.6349000      -1.534000      0.2416000    
 C   0.5593000      -2.256800      0.2105000    
 C  -0.5773000       2.667200     -2.1900000E-02
 C    1.863300       2.611600     -0.1735000    
 C   -1.793000       1.995800      9.6799999E-02
 C    3.057500       1.888800     -0.2047000    
 C    2.999900      -2.312400      5.8899999E-02
 C    4.242700     -0.2501000     -0.1477000    
 C    4.215600      -1.641000     -5.9900001E-02
 H   -1.535000      -2.133100      0.2960000    
 H   0.5158000      -3.342500      0.2718000    
 H  -0.5817000       3.753200     -8.9599997E-02
 H    1.907600       3.696600     -0.2435000    
 H   -2.698000       2.595500      0.1138000    
 H    3.995200       2.433100     -0.2979000    
 H    3.005000      -3.398300      0.1258000    
 H    5.204100      0.2509000     -0.2398000    
 H    5.144700      -2.203300     -8.4100001E-02
 H   -3.472900     -0.2744000      -2.032000    
 H   -4.754600      -2.115800      -2.074900    
 H   -5.469000     -0.8655000      -1.316300    


%chk=000174125-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000174125

0 1
S -3.543749 0.214320 0.012075
O -4.511595 1.500620 0.371164
O -3.686806 -1.172066 0.924312
N -4.279829 -0.802540 -1.960471
N -4.543392 -2.048467 -1.506845
C 0.673292 0.638432 0.050030
C 1.864283 -0.166235 0.015050
C -0.627900 -0.000152 0.092848
C 0.780847 2.078616 0.038671
C 1.770259 -1.604398 0.031326
C -1.758748 0.860524 0.103878
C 3.162548 0.462533 -0.036312
C -0.693220 -1.447079 0.138011
C 0.460000 -2.209647 0.102766
C -0.398934 2.868199 0.075627
C 2.094828 2.682739 -0.007248
C -1.668682 2.263930 0.093878
C 3.238798 1.907160 -0.045137
C 2.959743 -2.381328 -0.008377
C 4.327063 -0.351113 -0.076507
C 4.224330 -1.758457 -0.063172
H -1.674281 -1.918074 0.252861
H 0.394847 -3.303365 0.146527
H -0.315681 3.960526 0.080340
H 2.163578 3.776593 -0.012607
H -2.589958 2.855442 0.121144
H 4.228256 2.377582 -0.081584
H 2.884986 -3.474775 0.006320
H 5.312226 0.127723 -0.118029
H 5.132000 -2.370497 -0.093831
H -5.148126 -0.221349 -1.872741
H -3.772253 -2.710817 -1.611369
H -5.197630 -2.238281 -0.733299


