%chk=000080940.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080940

0 1
 S   -1.640000       1.769200     -0.1266000    
 O    3.758600     -3.2600001E-02   1.132700    
 O    3.278700      9.3999999E-03  -1.089000    
 N   -3.047700     -0.3524000      0.3208000    
 C   0.5439000      0.1673000     -0.7105000    
 C  -0.9039000      0.2466000     -0.3013000    
 C    1.469300      0.1675000      0.5023000    
 C   -1.776400     -0.7611000     -3.1700000E-02
 C   -1.500400      -2.211700     -7.8500003E-02
 C    2.909200      3.6499999E-02  7.7600002E-02
 C   -3.091300      0.9613000      0.3043000    
 H   0.7952000       1.001300      -1.379100    
 H   0.7009000     -0.7446000      -1.301400    
 H    1.362200       1.100100       1.067500    
 H    1.229800     -0.6735000       1.163100    
 H   -2.371800      -2.790600      0.2443000    
 H   -1.249000      -2.523200      -1.097200    
 H  -0.6650000      -2.469800      0.5799000    
 H   -3.990800       1.509900      0.5479000    
 H    4.693400     -0.1104000      0.8457000    


%chk=000080940-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080940

0 1
S -1.509043 1.812410 0.029541
O 3.854477 0.478125 1.227905
O 3.452067 -0.495461 -0.842016
N -3.115062 -0.299614 0.218215
C 0.610741 -0.023435 -0.642819
C -0.842529 0.149256 -0.289387
C 1.555865 0.303429 0.539930
C -1.844532 -0.806733 -0.138722
C -1.711236 -2.298210 -0.313696
C 3.009478 0.041412 0.197132
C -3.116910 1.010110 0.345146
H 0.883301 0.610511 -1.507261
H 0.786847 -1.063905 -0.966751
H 1.454218 1.357167 0.859352
H 1.295805 -0.304915 1.427389
H -1.986607 -2.819981 0.620486
H -2.401988 -2.652310 -1.099670
H -0.687349 -2.595931 -0.590614
H -3.982663 1.615048 0.612894
H 4.800018 0.282226 0.983747


