%chk=000148632.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148632

0 1
 S   0.4489000     -0.9373000      -1.701400    
 O    2.184700       1.940400      0.2041000    
 N    2.101600     -0.1541000      0.4087000    
 N    2.505100      0.8673000     -0.3212000    
 C    1.697500      -1.317400     -0.4050000    
 C  -0.9282000     -0.3943000     -0.7086000    
 C   -1.493600      -1.256600      0.2309000    
 C   -1.440500      0.8930000     -0.8710000    
 C   -2.571200     -0.8318000       1.008000    
 C   -2.518100       1.317800     -9.3699999E-02
 C    3.097100     -0.5823000       1.403600    
 C   -3.083400      0.4554000      0.8457000    
 H    1.288000      -2.105200      0.2371000    
 H    2.564200      -1.746700     -0.9246000    
 H   -1.118200      -2.267400      0.3690000    
 H   -1.012300       1.579400      -1.597300    
 H    2.688000      -1.377200       2.038000    
 H    3.361800      0.2439000       2.074900    
 H    4.018100     -0.9525000      0.9363000    
 H   -3.012900      -1.503800       1.738100    
 H   -2.917000       2.320000     -0.2197000    
 H   -3.922600      0.7861000       1.450500    


%chk=000148632-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148632

0 1
S 0.450485 -0.504397 -1.742044
O 4.783317 0.435098 -0.122220
N 2.706860 -0.461272 -0.010656
N 3.974092 -0.421318 -0.621110
C 1.772871 -1.368317 -0.637711
C -0.934767 -0.307624 -0.535632
C -1.544421 -1.436728 0.063231
C -1.422693 0.992744 -0.261290
C -2.624408 -1.259874 0.958398
C -2.517690 1.161394 0.617657
C 2.307219 0.444642 1.076026
C -3.114503 0.038023 1.236092
H 1.211915 -1.948072 0.112299
H 2.336030 -2.029125 -1.313285
H -1.197212 -2.445622 -0.187398
H -0.948999 1.860290 -0.733175
H 1.508234 1.125855 0.733600
H 3.197663 1.029461 1.361280
H 1.940760 -0.133264 1.942755
H -3.092671 -2.135509 1.421359
H -2.896608 2.168663 0.822696
H -3.958474 0.171652 1.921526


