%chk=000087838.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087838

0 1
 S    3.599600      0.1003000      4.3099999E-02
 S   -1.151300     -0.6195000      0.8551000    
 S   -3.710400      -1.959900      0.1914000    
 O    3.956400       1.609300      0.5486000    
 O    4.101600     -7.0799999E-02  -1.307800    
 O    3.930900     -0.8365000       1.101000    
 N   -3.331000      0.7681000      4.3000001E-03
 C    1.181000     -0.9329000     -0.6412000    
 C    1.844600      0.2889000     -1.8900000E-02
 C  -0.3389000     -0.8218000     -0.7483000    
 C   -2.837600     -0.5172000      0.3037000    
 C   -4.704400      0.9947000     -0.4525000    
 C   -2.540600       1.997300      0.1214000    
 H    1.583000      -1.091900      -1.649700    
 H    1.444900      -1.831200     -6.8400003E-02
 H    1.630700       1.179000     -0.6197000    
 H    1.512900      0.4646000       1.008200    
 H  -0.7244000      -1.725500      -1.231900    
 H  -0.5980000      2.8600000E-02  -1.388200    
 H   -5.252100      7.9400003E-02 -0.6758000    
 H   -4.672500       1.602900      -1.362200    
 H   -5.241200       1.541700      0.3289000    
 H   -2.100400       2.213400     -0.8565000    
 H   -1.749900       1.925800      0.8688000    
 H   -3.194800       2.825400      0.4126000    
 H    3.832300       2.321900     -0.1215000    


%chk=000087838-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087838

0 1
S 3.265886 0.616790 -0.366570
S -1.431358 -0.694840 0.948063
S -1.733546 -0.069058 -2.125997
O 3.122915 1.936607 -1.677130
O 4.327491 -0.513128 -0.835019
O 3.451172 1.309900 1.085175
N -3.164696 1.088690 -0.089281
C 1.273477 -1.284974 0.187769
C 1.459664 -0.000342 -0.622358
C -0.172847 -1.815217 0.100793
C -2.198310 0.208446 -0.502251
C -3.919172 1.918924 -1.053948
C -3.530709 1.256278 1.337225
H 1.949208 -2.071497 -0.201190
H 1.543823 -1.108762 1.246174
H 1.381360 -0.124986 -1.711508
H 0.852413 0.848657 -0.274353
H -0.261383 -2.779256 0.628131
H -0.515921 -1.921772 -0.944973
H -3.526051 1.744451 -2.065919
H -3.807874 2.987513 -0.794510
H -4.991229 1.648723 -1.028988
H -2.664464 1.598826 1.932060
H -3.898854 0.307129 1.767339
H -4.329128 2.010280 1.408448
H 3.988531 2.436716 -1.702682


