%chk=000150943.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150943

0 1
 S  -0.8760000      -1.499600      0.2656000    
 O    2.707500      0.1777000      -1.113800    
 N   -1.522500      0.9686000     -0.1500000    
 N   -3.260200     -0.5975000     -0.4932000    
 C    1.693800     -0.6920000      0.9135000    
 C   0.3014000     -0.2953000      0.4835000    
 C  -0.1942000      0.9425000      0.2276000    
 C    2.604200     -0.9695000     -0.2797000    
 C   0.5301000       2.227300      0.3111000    
 C   -1.984300     -0.2621000     -0.1646000    
 H    1.658300      -1.576700       1.560700    
 H    2.122200      0.1176000       1.516400    
 H    2.216700      -1.792000     -0.8894000    
 H    3.608800      -1.243600      5.7999998E-02
 H  -0.1717000       3.061200      0.4180000    
 H    1.204400       2.256300       1.172100    
 H    1.114900       2.398200     -0.5975000    
 H   -3.576500      -1.561600     -0.4922000    
 H   -3.946500      0.1029000     -0.7538000    
 H    3.100000      0.8900000     -0.5807000    


%chk=000150943-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150943

0 1
S -0.882819 -1.614837 0.287117
O 2.901203 0.071092 -1.179326
N -1.573958 0.938574 -0.148147
N -3.354675 -0.604552 -0.574852
C 1.751070 -0.638468 0.949822
C 0.344958 -0.276259 0.559908
C -0.224357 0.953502 0.269231
C 2.663501 -1.033840 -0.242934
C 0.463683 2.293055 0.337835
C -2.067219 -0.285764 -0.201359
H 1.748454 -1.483495 1.667286
H 2.212969 0.216074 1.484930
H 2.178420 -1.812863 -0.853182
H 3.624692 -1.432007 0.150043
H -0.169918 3.016007 0.881259
H 1.441154 2.230254 0.844841
H 0.627285 2.693584 -0.679483
H -3.681573 -1.564183 -0.616750
H -3.975293 0.156693 -0.839932
H 3.302821 0.829834 -0.684709


