%chk=000053027.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053027

0 1
 S   -2.294500      0.7993000       1.403100    
 S    2.090700       2.351000      0.8107000    
 O   -1.005900     -0.2186000      -1.913900    
 O    2.238400      -1.386500       1.234600    
 O    3.795900     -0.8063000     -0.3074000    
 N   0.2436000     -0.2377000      2.8500000E-02
 C   -2.189000     -0.5645000      0.1784000    
 C  -0.9411000     -0.3237000     -0.6886000    
 C    1.523300     -1.4700000E-02 -0.6034000    
 C   -2.052300      -1.880900      0.9558000    
 C   -3.466900     -0.6009000     -0.6661000    
 C    1.828800       1.476200     -0.7679000    
 C    2.642900     -0.7599000      0.1039000    
 C   -2.414100       2.167300      0.2324000    
 H    1.463800     -0.4630000      -1.603800    
 H   -1.907300      -2.719600      0.2638000    
 H   -1.195000      -1.887600       1.638500    
 H   -2.950800      -2.096200       1.546300    
 H   -3.473800      -1.494900      -1.302500    
 H   -4.369100     -0.6419000     -4.4900000E-02
 H   -3.554100      0.2495000      -1.349600    
 H   0.2142000     -0.2832000       1.042700    
 H    1.014100       1.979500      -1.299200    
 H    2.740400       1.606400      -1.360800    
 H   -2.360700       3.101300      0.8003000    
 H   -3.374100       2.166300     -0.2883000    
 H   -1.592900       2.182900     -0.4869000    
 H   0.8686000       2.123400       1.314200    
 H    2.974100      -1.866300       1.671400    


%chk=000053027-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000053027

0 1
S -2.247237 0.213833 1.774606
S 1.933049 2.645586 -0.497273
O -0.773249 -0.758451 -1.919561
O 2.169595 -0.365317 1.855603
O 3.892817 -0.470802 0.299050
N 0.242129 -0.187422 0.085773
C -2.213671 -0.692501 0.070729
C -0.859884 -0.520412 -0.671827
C 1.583011 -0.223090 -0.503648
C -2.360756 -2.195166 0.434017
C -3.375723 -0.227653 -0.826325
C 1.895936 0.993759 -1.415880
C 2.676740 -0.367217 0.552751
C -2.298502 2.022467 1.251108
H 1.647491 -1.112265 -1.166691
H -2.313673 -2.796724 -0.491170
H -1.556654 -2.532011 1.112330
H -3.333190 -2.373503 0.924675
H -3.343177 -0.785965 -1.777817
H -4.340037 -0.414684 -0.323545
H -3.304789 0.845424 -1.074120
H 0.129975 -0.035716 1.096543
H 1.153028 1.037680 -2.225700
H 2.906462 0.886044 -1.840471
H -2.141978 2.608307 2.170397
H -3.275638 2.274018 0.813537
H -1.488519 2.239304 0.535336
H 0.577281 2.679718 -0.210706
H 2.916364 -0.430540 2.509580


