%chk=000084815.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084815

0 1
 S   -2.321600     -0.9566000     -0.3220000    
 O    1.199000      -1.637700     -0.6749000    
 O    2.617400     -0.3325000      0.5181000    
 N    1.333200       1.895100     -0.4765000    
 C  -0.4200000      0.7632000      0.8024000    
 C   0.5692000      0.6484000     -0.3663000    
 C   -1.263700     -0.4848000       1.078200    
 C    1.580500     -0.4573000     -0.1216000    
 C   -3.294100      0.5622000     -0.4374000    
 H   0.1442000      0.9659000       1.724500    
 H   -1.066200       1.638200      0.6645000    
 H   6.8099998E-02  0.4775000      -1.323800    
 H   -1.902500     -0.3126000       1.951300    
 H  -0.6237000      -1.337400       1.325900    
 H    1.781500       2.107800      0.4146000    
 H   0.6941000       2.668800     -0.6567000    
 H   -3.666700      0.8659000      0.5444000    
 H   -4.155100      0.3793000      -1.086600    
 H   -2.707000       1.368600     -0.8832000    
 H    1.850400      -2.350300     -0.5013000    


%chk=000084815-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084815

0 1
S -2.466691 -0.654488 -0.720124
O 1.453363 -1.701961 -0.206130
O 2.913471 -0.075501 0.570475
N 1.378337 1.896601 -0.621421
C -0.373467 0.656250 0.765440
C 0.727466 0.610861 -0.361249
C -1.327636 -0.551667 0.793864
C 1.819808 -0.373390 0.040838
C -3.682157 0.713495 -0.276631
H 0.122001 0.767391 1.752240
H -0.952895 1.585501 0.600319
H 0.236465 0.234598 -1.278445
H -1.976045 -0.526685 1.687601
H -0.773842 -1.504698 0.785724
H 2.168760 2.111958 -0.009250
H 0.752583 2.677583 -0.819860
H -4.160310 0.496819 0.692555
H -4.446663 0.718015 -1.069284
H -3.183753 1.695569 -0.246552
H 2.188203 -2.304553 0.093488