%chk=000076832.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076832

0 1
 S    1.791700      -1.337400     -0.4277000    
 N   -1.050500      -1.134900      0.2667000    
 C   0.9417000      8.4700003E-02  1.4300000E-02
 C  -0.4972000      6.9799997E-02  2.6000000E-03
 C    1.801700       1.114000      0.3409000    
 C   -1.227100       1.217500     -0.2622000    
 C    3.169000      0.7303000      0.2259000    
 C   -2.614200       1.122500     -0.2549000    
 C    3.306700     -0.5778000     -0.1834000    
 C   -3.220400     -0.1000000      1.2800000E-02
 C   -2.401300      -1.188600      0.2649000    
 H    1.479000       2.099300      0.6541000    
 H  -0.7568000       2.171100     -0.4784000    
 H    4.008900       1.380100      0.4344000    
 H   -3.222000       1.998800     -0.4591000    
 H    4.224400      -1.123700     -0.3504000    
 H   -4.299900     -0.1975000      2.3200000E-02
 H   -2.824600      -2.164500      0.4790000    


%chk=000076832-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076832

0 1
S 1.851545 -1.499585 0.074585
N -1.098934 -1.179675 0.036593
C 0.960690 0.078070 0.033409
C -0.502400 0.061526 0.016386
C 1.852103 1.150783 0.022545
C -1.273211 1.259694 -0.019521
C 3.235722 0.759314 0.044473
C -2.678685 1.170588 -0.034973
C 3.410022 -0.617927 0.073695
C -3.293117 -0.104387 -0.014435
C -2.457431 -1.244626 0.021204
H 1.532368 2.195699 -0.001907
H -0.780241 2.236253 -0.034812
H 4.065255 1.470404 0.039357
H -3.287499 2.080636 -0.062702
H 4.339264 -1.185157 0.095528
H -4.381595 -0.213994 -0.025170
H -2.884757 -2.253918 0.038447


