%chk=000227330.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227330

0 1
 S    1.683600       2.346200     -0.3019000    
 O   -2.185600      8.8500001E-02  -1.287700    
 N   -3.666800     -0.5172000      0.3967000    
 N   -4.647100     -0.9109000     -0.4909000    
 C  -0.1903000      0.8133000      0.5297000    
 C   0.9292000     -5.3800002E-02  0.2948000    
 C   -1.510500      0.3498000       1.025500    
 C    2.036300      0.6635000     -0.1689000    
 C   8.4500000E-02   2.130200      0.2474000    
 C    1.059600      -1.454200      0.4584000    
 C    3.255000      2.4000000E-02 -0.4695000    
 C   -2.467300     -2.9700000E-02 -9.7499996E-02
 C    2.267300      -2.091500      0.1614000    
 C    3.352100      -1.358100     -0.2977000    
 H   -1.988100       1.142000       1.617100    
 H   -1.396100     -0.5111000       1.694700    
 H  -0.5783000       2.979800      0.3363000    
 H   0.2230000      -2.050600      0.8136000    
 H    4.109500      0.5901000     -0.8293000    
 H    2.354800      -3.166700      0.2904000    
 H    4.287100      -1.862500     -0.5264000    
 H   -3.857200     -0.5975000       1.390500    
 H   -4.867700      -1.882400     -0.2759000    
 H   -5.484100     -0.3756000     -0.2635000    


%chk=000227330-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227330

0 1
S 1.895288 2.411425 -0.383430
O -2.857968 0.825025 -0.958431
N -3.130970 -0.983997 0.472519
N -4.060767 -1.669871 -0.353288
C -0.225860 1.111107 0.609096
C 0.768794 0.077861 0.331989
C -1.601941 0.828046 1.174662
C 1.984945 0.607294 -0.206425
C 0.219333 2.374039 0.284790
C 0.673364 -1.327609 0.528385
C 3.081417 -0.212738 -0.539003
C -2.569911 0.242529 0.124602
C 1.762937 -2.155500 0.200131
C 2.961514 -1.603416 -0.330143
H -2.056718 1.771107 1.527225
H -1.525518 0.154371 2.051017
H -0.322740 3.314730 0.370777
H -0.248491 -1.765271 0.927247
H 4.003084 0.211919 -0.949740
H 1.689101 -3.237969 0.351152
H 3.799867 -2.261959 -0.581527
H -2.918491 -1.436501 1.362926
H -3.622703 -1.921830 -1.250976
H -4.894666 -1.087191 -0.516256


