%chk=000112995.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112995

0 1
 S   -1.161800      0.7260000      0.9168000    
 S   0.1163000       3.135200     -0.3525000    
 O    1.407800      0.9447000     -4.6700001E-02
 O    3.274100      -2.099900      0.3876000    
 O   -4.113900     -0.1966000      0.4372000    
 O    3.864600     -0.1214000     -0.5739000    
 N   -3.144400      -2.037900     -0.5391000    
 C   -1.944000      5.7700001E-02 -0.5696000    
 C    1.636300     -0.4186000      0.3482000    
 C   -3.177600     -0.7121000     -0.1700000    
 C   0.2033000       1.546500      0.1714000    
 C    3.039400     -0.8237000     -9.3000000E-03
 H   -2.254200      0.8681000      -1.236800    
 H   -1.236900     -0.5775000      -1.110600    
 H    1.518500     -0.5041000       1.433000    
 H   0.9471000      -1.076300     -0.1895000    
 H   -3.918000      -2.657200     -0.3212000    
 H   -2.361700      -2.449500      -1.037000    
 H    4.184600      -2.390400      0.1666000    


%chk=000112995-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112995

0 1
S -0.817646 -0.209074 0.770986
S -0.688413 0.796444 -2.222817
O 1.387019 -0.019141 -0.801109
O 4.198990 -1.073923 1.245326
O -4.231789 -1.530842 0.738965
O 4.115939 -0.430311 -0.998071
N -3.322304 -1.232932 -1.389043
C -2.612867 0.277922 0.410060
C 2.065170 -0.512933 0.414619
C -3.464441 -0.914427 -0.055910
C 0.025382 0.197535 -0.818108
C 3.546238 -0.645025 0.081431
H -2.998309 0.635179 1.375509
H -2.569371 1.093006 -0.333829
H 1.934161 0.195172 1.253889
H 1.664297 -1.499532 0.714200
H -3.844643 -2.027076 -1.758773
H -2.680558 -0.706259 -1.992230
H 5.172647 -1.180784 1.069504


