%chk=000093583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093583

0 1
 S   0.2482000     -0.3265000      -1.424000    
 O   0.2329000      0.8767000      -2.264300    
 O   0.2098000      -1.647600      -2.059800    
 O   -1.583500       2.075500     -0.1790000    
 O  -0.3015000       1.159200       1.513700    
 C   -1.094600     -0.2439000     -0.2459000    
 C   -2.431800     -0.2823000      -1.000200    
 C  -0.9708000      -1.411400      0.7441000    
 C   -3.634700     -0.4176000     -6.6399999E-02
 C   -2.184400      -1.537600       1.665200    
 C   -3.486300      -1.607500      0.8750000    
 C  -0.9393000       1.070200      0.4743000    
 C    1.748300     -0.2430000     -0.4758000    
 C    2.319400      -1.416000     -2.6300000E-02
 C    2.303300      0.9927000     -0.2131000    
 C    3.496900      -1.350500      0.7186000    
 C    3.480900       1.058200      0.5316000    
 C   -1.490700       3.365000      0.4347000    
 C    4.077700     -0.1135000      0.9975000    
 H   -2.437400      -1.153800      -1.669900    
 H   -2.574300      0.5788000      -1.663900    
 H  -8.1299998E-02  -1.324900       1.377500    
 H  -0.8656000      -2.358000      0.1983000    
 H   -4.546700     -0.5371000     -0.6626000    
 H   -3.760600      0.5003000      0.5198000    
 H   -2.221100     -0.6869000       2.356000    
 H   -2.082500      -2.438200       2.281700    
 H   -4.335900      -1.638900       1.566400    
 H   -3.512300      -2.538200      0.2950000    
 H    1.880600      -2.387500     -0.2300000    
 H    1.852800       1.916100     -0.5628000    
 H    3.960900      -2.262500       1.082500    
 H    3.932600       2.021500      0.7502000    
 H  -0.4453000       3.683500      0.4885000    
 H   -1.940300       3.342300       1.431900    
 H   -2.043500       4.076600     -0.1842000    
 H    4.994100     -6.2399998E-02   1.578000    


%chk=000093583-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093583

0 1
S 0.364176 0.089458 -1.417121
O 0.481048 1.609644 -2.012907
O 0.166671 -1.196872 -2.415178
O -2.135311 2.249721 -0.267782
O -0.532264 1.856745 1.373302
C -1.274949 0.009627 -0.068780
C -2.443571 -0.425929 -0.948837
C -0.891361 -1.019014 0.994786
C -3.678009 -0.755195 -0.060076
C -2.130148 -1.334178 1.883064
C -3.332467 -1.797012 1.029245
C -1.269055 1.436646 0.443832
C 1.930952 -0.258319 -0.406004
C 2.470493 -1.553060 -0.473360
C 2.512705 0.800089 0.312038
C 3.668989 -1.801331 0.235589
C 3.708342 0.529239 1.017491
C -2.044306 3.700918 0.026282
C 4.280433 -0.764926 0.980528
H -2.135644 -1.328930 -1.511355
H -2.696587 0.358583 -1.680277
H -0.062955 -0.644333 1.619841
H -0.564391 -1.952623 0.495770
H -4.490301 -1.128357 -0.711636
H -4.046493 0.176182 0.413617
H -2.405046 -0.429599 2.461140
H -1.850040 -2.111636 2.618484
H -4.211679 -1.972327 1.678142
H -3.088860 -2.765761 0.546842
H 1.982426 -2.320548 -1.083235
H 2.055760 1.793586 0.314455
H 4.123632 -2.796920 0.200219
H 4.189318 1.328042 1.591377
H -1.047630 4.067371 -0.269808
H -2.206296 3.885694 1.101249
H -2.832481 4.160175 -0.585527
H 5.208899 -0.964048 1.526891


