%chk=000137690.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137690

0 1
 S    3.153700       1.230300      -1.148400    
 O  -0.2992000      -2.853600     -0.2816000    
 O    1.419800      -1.715400      0.4724000    
 N   0.2310000      -1.776900      7.9800002E-02
 N    1.328100      0.7322000      0.8788000    
 C  -0.5429000     -0.5836000      4.2800002E-02
 C   1.9000000E-03  0.6391000      0.4357000    
 C   -1.866000     -0.6494000     -0.3942000    
 C  -0.7766000       1.795700      0.3914000    
 C   -2.644300      0.5073000     -0.4386000    
 C   -2.099600       1.729800     -4.5699999E-02
 C    2.094100      0.9444000      7.7000000E-03
 H   -2.327200      -1.582100     -0.7086000    
 H  -0.3650000       2.754300      0.6972000    
 H   -3.674500      0.4566000     -0.7787000    
 H   -2.706000       2.630200     -7.9700001E-02


%chk=000137690-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137690

0 1
S 4.141867 1.330597 0.248992
O -0.495034 -2.954335 -0.184221
O 1.451449 -1.771720 -0.189144
N 0.163614 -1.841141 -0.163974
N 1.349368 0.904633 0.082884
C -0.620499 -0.583245 -0.114478
C 0.000888 0.705000 -0.000060
C -2.027345 -0.703946 -0.186708
C -0.851325 1.849924 0.037376
C -2.843609 0.439586 -0.151200
C -2.248050 1.720705 -0.038601
C 2.542861 1.082144 0.151733
H -2.449346 -1.708743 -0.270293
H -0.382885 2.834361 0.127375
H -3.930978 0.336500 -0.210222
H -2.873676 2.618579 -0.009160


