%chk=000174768.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174768

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     -0.3125000       1.951300    
 H  -0.6237000      -1.337400       1.325800    
 H    1.781500       2.107800      0.4145000    
 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=000174768-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000174768

0 1
S -2.466695 -0.654485 -0.720123
O 1.453360 -1.701960 -0.206135
O 2.913472 -0.075498 0.570458
N 1.378337 1.896600 -0.621443
C -0.373465 0.656258 0.765428
C 0.727465 0.610862 -0.361264
C -1.327636 -0.551658 0.793861
C 1.819807 -0.373389 0.040825
C -3.682157 0.713504 -0.276634
H 0.122006 0.767403 1.752227
H -0.952892 1.585509 0.600304
H 0.236461 0.234595 -1.278457
H -1.976042 -0.526670 1.687600
H -0.773843 -1.504690 0.785725
H 2.168762 2.111959 -0.009276
H 0.752583 2.677582 -0.819885
H -4.160307 0.496834 0.692554
H -4.446665 0.718020 -1.069285
H -3.183751 1.695577 -0.246562
H 2.188199 -2.304552 0.093484


