%chk=000138727.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138727

0 1
 S   -2.349200      0.6596000      0.5413000    
 O    2.664000      0.8192000     -0.3102000    
 N   0.3503000      0.7666000      8.9299999E-02
 N  -0.7251000      -1.357900      0.2944000    
 C  -0.7628000     -6.1400000E-02  0.2877000    
 C    1.615600      0.2064000     -0.1218000    
 C   0.2702000       2.229400      0.1146000    
 C    1.641600      -1.273300     -0.1113000    
 C   0.4981000      -1.931200      9.1200002E-02
 C   -3.202800     -5.7399999E-02 -0.8751000    
 H  -0.1233000       2.546800       1.085000    
 H  -0.4150000       2.560000     -0.6720000    
 H    1.243200       2.701100     -4.3400001E-02
 H    2.583200      -1.784800     -0.2673000    
 H   0.5051000      -3.016400      0.1009000    
 H   -3.286000      -1.142500     -0.7704000    
 H   -2.671300      0.1767000      -1.801700    
 H   -4.211000      0.3606000     -0.9387000    


%chk=000138727-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138727

0 1
S -2.252560 1.091227 -0.341447
O 2.792721 0.862344 0.353904
N 0.451318 0.850584 0.017412
N -0.744772 -1.195583 -0.395995
C -0.704149 0.126106 -0.233326
C 1.750979 0.181622 0.123963
C 0.426906 2.320074 0.187432
C 1.674731 -1.258321 -0.057857
C 0.460875 -1.877724 -0.304610
C -3.462749 -0.306846 -0.682592
H -0.203045 2.597964 1.050358
H 0.035945 2.806788 -0.723004
H 1.465860 2.636953 0.365245
H 2.608939 -1.819500 0.009085
H 0.393059 -2.961546 -0.442565
H -3.442334 -1.019578 0.152278
H -3.181048 -0.814309 -1.614522
H -4.445876 0.181245 -0.771261


