%chk=000151527.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151527

0 1
 S   -3.020200      0.4457000      -1.389800    
 S    3.044600       2.112100      7.9700001E-02
 O   -3.011600     -0.1365000      -2.727600    
 O   -3.873100       1.594800      -1.111600    
 O  -0.9843000       2.578300       2.162900    
 N   -1.831400       1.979700       1.246000    
 N   0.3331000       2.557300       1.738200    
 C   -1.401100      0.9124000     -0.9546000    
 C   -1.051200       1.576800      0.2353000    
 C   -3.536300     -0.8754000     -0.3234000    
 C   0.3246000       1.943800      0.5481000    
 C  -0.3160000      0.6368000      -1.806500    
 C    1.395500       1.658400     -0.3188000    
 C    1.023800      0.9943000      -1.501800    
 C   -4.173700     -0.5678000      0.8622000    
 C   -3.288400      -2.179100     -0.7052000    
 C    3.876600      0.5249000      9.6900001E-02
 C   -4.579800      -1.606400       1.700300    
 C   -3.694600      -3.217600      0.1327000    
 C   -4.340400      -2.931200       1.335400    
 C    3.458100     -0.4610000      0.9827000    
 C    4.933500      0.2933000     -0.7756000    
 C    5.167000      -1.937000      0.1234000    
 C    4.105800      -1.696300      0.9961000    
 C    5.580900     -0.9422000     -0.7623000    
 C    5.858800      -3.258000      0.1373000    
 H  -0.4846000      0.1236000      -2.752100    
 H    1.788800      0.7362000      -2.234300    
 H   -4.369900      0.4559000       1.163900    
 H   -2.778400      -2.423000      -1.631700    
 H   -5.082400      -1.383700       2.637000    
 H   -3.506000      -4.249200     -0.1499000    
 H   -4.656100      -3.739800       1.988200    
 H    2.636900     -0.2929000       1.674700    
 H    5.267800       1.057100      -1.472800    
 H    3.773700      -2.463700       1.690300    
 H    6.405100      -1.118300      -1.448500    
 H    5.839000      -3.704000       1.137500    
 H    5.372000      -3.944400     -0.5626000    
 H    6.911800      -3.155700     -0.1466000    


%chk=000151527-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000151527

0 1
S -2.776469 -0.124399 -1.661757
S 2.872194 1.272354 1.478595
O -2.332108 -1.340831 -2.667182
O -3.380959 1.281597 -2.223100
O -1.414576 2.836525 1.862049
N -2.119742 2.052120 0.867256
N -0.016520 2.507031 1.923494
C -1.203463 0.256048 -0.672736
C -1.147638 1.260623 0.336356
C -3.995318 -0.846544 -0.400658
C 0.135298 1.537329 0.984134
C -0.047815 -0.425867 -1.018375
C 1.333751 0.825288 0.614181
C 1.211059 -0.148411 -0.379569
C -4.780686 0.046944 0.345048
C -4.097733 -2.244480 -0.328263
C 4.083467 0.126331 0.682001
C -5.717028 -0.512029 1.246214
C -5.041823 -2.780771 0.578313
C -5.843011 -1.916868 1.362714
C 4.346883 -1.130890 1.269390
C 4.796027 0.543755 -0.465020
C 6.046250 -1.583654 -0.461190
C 5.323550 -1.976079 0.695770
C 5.768825 -0.311043 -1.028017
C 7.077073 -2.503748 -1.089033
H -0.112418 -1.186622 -1.805976
H 2.092191 -0.715684 -0.691907
H -4.669898 1.128933 0.222983
H -3.479336 -2.878773 -0.972079
H -6.345920 0.150257 1.849799
H -5.155273 -3.866493 0.663806
H -6.573998 -2.340267 2.060179
H 3.801366 -1.441137 2.166396
H 4.596219 1.525514 -0.906218
H 5.528363 -2.949172 1.157009
H 6.321985 0.017527 -1.915669
H 7.450639 -3.249423 -0.366740
H 6.642025 -3.058888 -1.942499
H 7.942468 -1.937906 -1.476600


