%chk=000109917.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000109917

0 1
 S    1.915900       2.049800      0.3403000    
 S   -1.237900       2.388000      0.1092000    
 S   -4.225500       2.655300     -0.1187000    
 O   -1.121000      -1.332800     -0.7292000    
 O   -3.863300     -0.7602000       1.568800    
 O   -5.490500      -1.803500      0.3807000    
 N    1.555100     -0.5290000     -0.2839000    
 N   -2.723700      0.3717000     -0.4997000    
 C   0.8638000      0.6665000     -7.9099998E-02
 C    2.943400     -0.3674000     -0.1119000    
 C    1.013000      -1.827500     -0.6349000    
 C    3.326000      0.9502000      0.2268000    
 C  -0.4583000      0.8842000     -0.1596000    
 C   -1.439200     -0.1738000     -0.4977000    
 C    3.928600      -1.342100     -0.2392000    
 C    4.652100       1.302100      0.4370000    
 C   0.7093000      -2.653600      0.5979000    
 C   -2.840400       1.723900     -0.1997000    
 C   -3.896300     -0.4440000     -0.8044000    
 C    5.268200     -0.9969000     -2.9400000E-02
 C    5.626900      0.3148000      0.3062000    
 C   -4.506200      -1.075500      0.4204000    
 H   0.4490000      -1.876400      -1.573900    
 H    1.830900      -2.414200      -1.077100    
 H    3.716400      -2.377200     -0.4794000    
 H    4.934500       2.317100      0.6972000    
 H    1.613500      -2.835800       1.189600    
 H  -1.2900000E-02  -2.169500       1.263200    
 H   0.3047000      -3.629200      0.3090000    
 H   -3.581400      -1.260300      -1.463800    
 H   -4.660800      0.1460000      -1.315800    
 H    6.040300      -1.756100     -0.1237000    
 H    6.672600      0.5626000      0.4662000    
 H   -4.279200      -1.182500       2.350400    


%chk=000109917-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000109917

0 1
S 1.915506 1.940340 0.335109
S -1.238837 2.154319 0.699270
S -4.313467 2.551170 0.553769
O -1.466730 -1.215938 -1.395914
O -4.193971 -1.163102 1.218480
O -6.101939 -1.196121 -0.111517
N 1.669187 -0.642336 -0.276257
N -2.847901 0.460671 -0.487660
C 0.872228 0.474267 -0.052581
C 3.069477 -0.408904 -0.202398
C 1.150672 -2.042919 -0.307117
C 3.407337 0.928861 0.129782
C -0.517063 0.634274 -0.067435
C -1.560171 -0.155266 -0.693462
C 4.097380 -1.360001 -0.397919
C 4.739947 1.348147 0.269784
C 1.096769 -2.656522 1.105927
C -2.924471 1.662885 0.200229
C -4.043744 -0.200421 -1.007495
C 5.439918 -0.944215 -0.264913
C 5.764661 0.394597 0.064361
C -4.907823 -0.877727 0.054769
H 0.155245 -2.030356 -0.779226
H 1.816695 -2.621477 -0.969782
H 3.868298 -2.399230 -0.647751
H 4.982462 2.383341 0.527784
H 2.090303 -2.675053 1.588434
H 0.403329 -2.091751 1.753089
H 0.725302 -3.694594 1.038189
H -3.691968 -0.976059 -1.714534
H -4.682322 0.522323 -1.540575
H 6.241267 -1.674068 -0.418890
H 6.811919 0.696530 0.162778
H -4.799896 -1.600966 1.875469


