%chk=000116789.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116789

0 1
 S  -0.5999000       1.714000      3.3399999E-02
 O  -0.4616000       2.503100      -1.177300    
 O  -0.5333000       2.347900       1.337500    
 N  -0.8532000      -1.300300      5.2299999E-02
 N   -1.961900      0.8455000     -6.4199999E-02
 N    1.537200      -1.666300      9.9999997E-05
 C   0.7240000      0.5618000      2.7000001E-03
 C   0.4795000     -0.8081000      1.8999999E-02
 C   -1.954800     -0.4520000     -4.2300001E-02
 C    2.024400       1.066200     -3.4600001E-02
 C  -0.9430000      -2.760500      9.8300003E-02
 C   -3.341100      -1.069300     -0.1340000    
 C    3.089100      0.1828000     -5.5000000E-02
 C    2.794700      -1.164800     -3.5900000E-02
 H    2.213300       2.135600     -4.5600001E-02
 H  -0.3257000      -3.170700      0.9067000    
 H  -0.6191000      -3.194000     -0.8546000    
 H   -1.957600      -3.118500      0.2919000    
 H   -3.574800      -1.586000      0.8011000    
 H   -3.381100      -1.773500     -0.9697000    
 H   -4.099600     -0.2977000     -0.2996000    
 H    4.113100      0.5358000     -8.3400004E-02
 H    3.585200      -1.907900     -4.9500000E-02


%chk=000116789-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000116789

0 1
S -0.598380 1.862113 0.319671
O -0.361000 3.165304 -0.613243
O -0.784980 2.039264 1.925620
N -0.841738 -1.247975 0.189731
N -2.063348 0.845435 -0.326020
N 1.485230 -1.674525 0.029361
C 0.778088 0.633369 0.010931
C 0.483392 -0.750126 0.091395
C -1.964862 -0.475449 -0.175216
C 2.083940 1.082740 -0.228102
C -0.994657 -2.702848 0.460388
C -3.258039 -1.214230 -0.476873
C 3.112601 0.118801 -0.320529
C 2.761871 -1.241786 -0.153023
H 2.281192 2.155332 -0.326730
H -0.164981 -3.026793 1.102807
H -0.951035 -3.294221 -0.471220
H -1.949717 -2.881291 0.974215
H -3.728713 -1.577934 0.455194
H -3.097276 -2.073752 -1.149799
H -3.951318 -0.502374 -0.947946
H 4.151091 0.409631 -0.497574
H 3.526438 -2.025582 -0.175738


