%chk=000093796.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093796

0 1
 S    1.631300       1.295700      0.1197000    
 O    1.951800       2.054100      -1.076300    
 O    1.907300       1.793600       1.454200    
 O   -4.598800     -0.8625000       1.025000    
 O   -4.619300     -0.6006000      -1.154500    
 N    2.589700     -0.1312000     -6.0500000E-02
 N    2.978500     -0.6013000      -1.218800    
 N    3.683700      -1.852400      0.5616000    
 N   -4.030700     -0.5439000     -4.7600001E-02
 C  -2.8700000E-02  0.7562000      7.0900001E-02
 C  -0.6805000      0.3970000       1.250600    
 C  -0.7030000      0.6844000      -1.148100    
 C   -2.681000     -0.1056000     -7.7000000E-03
 C   -2.006500     -3.4100000E-02   1.211300    
 C   -2.029100      0.2537000      -1.187400    
 C    2.980900     -0.8333000      0.9986000    
 C    3.654600      -1.669800     -0.7913000    
 H  -0.1732000      0.4386000       2.210400    
 H  -0.2122000      0.9544000      -2.078900    
 H   -2.481900     -0.3075000       2.149900    
 H   -2.522400      0.2092000      -2.155100    
 H    2.758800     -0.6153000       2.034100    
 H    4.141500      -2.336200      -1.487600    


%chk=000093796-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093796

0 1
S 1.623459 1.457808 0.350849
O 1.953638 2.444729 -0.878653
O 1.909522 1.852662 1.892105
O -4.737872 -0.905408 0.851998
O -4.566135 -0.751159 -1.418483
N 2.633591 -0.150444 0.125338
N 2.403565 -0.906597 -1.025160
N 4.078807 -1.824800 0.297230
N -4.091258 -0.627799 -0.227337
C -0.130690 0.787122 0.168363
C -0.834976 0.492762 1.346583
C -0.641637 0.647194 -1.131971
C -2.690925 -0.127860 -0.087217
C -2.157599 0.021560 1.211247
C -1.964774 0.176987 -1.259399
C 3.637684 -0.699900 0.905499
C 3.307124 -1.910724 -0.866214
H -0.375057 0.642039 2.328437
H -0.036174 0.901296 -2.006178
H -2.771443 -0.225604 2.080831
H -2.433136 0.040431 -2.237096
H 3.985047 -0.278267 1.843436
H 3.410038 -2.712829 -1.591707


