%chk=000171274.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171274

0 1
 S   -1.311000      -1.323100     -0.5432000    
 O    1.785400      -2.144800      0.5887000    
 O    2.036400       2.019100     -0.6113000    
 N   0.9321000      8.1000002E-03  2.4100000E-02
 N   -1.163800       1.051100      0.4097000    
 N   -2.515400      0.7829000      0.2809000    
 C    1.687300      -1.157700     -0.4306000    
 C    1.730000       1.149200      0.4719000    
 C  -0.4509000      3.6300000E-02  1.4700000E-02
 C   -2.730100     -0.4211000     -0.2048000    
 H    1.274800      -1.613000      -1.337300    
 H    2.711000     -0.8686000     -0.6982000    
 H    2.671700      0.8108000      0.9191000    
 H    1.199700       1.725100       1.238900    
 H   -3.722700     -0.8127000     -0.3775000    
 H    2.064600      -1.684400       1.398100    
 H    2.568200       2.748400     -0.2497000    


%chk=000171274-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000171274

0 1
S -1.335018 -1.410704 -0.251931
O 1.702943 -2.433375 0.477806
O 1.727603 2.237759 -0.415544
N 1.137820 -0.071652 0.172525
N -0.865363 1.216674 0.057326
N -2.257159 1.101968 -0.099086
C 1.880471 -1.233310 -0.334227
C 1.824863 1.192894 0.574175
C -0.228715 0.027102 0.013333
C -2.658017 -0.145081 -0.289216
H 1.511061 -1.541219 -1.326593
H 2.942283 -0.930306 -0.407710
H 2.896646 0.969581 0.691010
H 1.382063 1.515227 1.536999
H -3.696566 -0.424126 -0.460000
H 2.038374 -2.271473 1.396927
H 0.764010 2.505641 -0.442291


