%chk=000132865.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132865

0 1
 S   0.4669000       1.409700      0.1867000    
 O   1.5000000E-02   2.577700     -0.5438000    
 O  -5.7999998E-02   1.120000       1.508200    
 O    1.172400      -2.826800      0.7075000    
 O   -1.930300      -2.415000       1.133700    
 O    3.667300      -1.315300      -1.430100    
 O    4.995000     -0.1856000      4.8900001E-02
 N    1.529100     -0.7586000     -0.3685000    
 C   0.3433000     -3.6200002E-02 -0.8545000    
 C    2.315700       1.413100      0.2683000    
 C  -0.4851000      -1.254700     -0.4307000    
 C    2.624800     -9.5799997E-02  0.3126000    
 C   0.8444000      -1.851900      7.0100002E-02
 C   -1.547900      -1.119500      0.6599000    
 C    2.782400       2.131600       1.535100    
 C    2.872600       2.127500     -0.9729000    
 C    3.892300     -0.5241000     -0.3537000    
 C   -2.790600     -0.3922000      0.1846000    
 C   -3.526800      0.3458000       1.093000    
 C   -3.156700     -0.4844000      -1.145600    
 C   -4.669800       1.015100      0.6559000    
 C   -4.299700      0.1850000      -1.582600    
 C   -5.056300      0.9348000     -0.6819000    
 H   0.3883000      0.1782000      -1.925900    
 H  -0.8199000      -1.862000      -1.284000    
 H    2.638800     -0.4805000       1.340000    
 H   -1.160000     -0.6596000       1.561800    
 H    3.875400       2.133900       1.605300    
 H    2.438600       3.171900       1.545500    
 H    2.393100       1.652600       2.439900    
 H    2.536800       3.169900      -1.012100    
 H    3.967500       2.145000     -0.9696000    
 H    2.543900       1.645700      -1.900000    
 H   -2.419700      -2.863800      0.4230000    
 H    4.503000      -1.592400      -1.862500    
 H   -3.234300      0.4129000       2.136600    
 H   -2.616300      -1.071300      -1.877900    
 H   -5.259200       1.598500       1.357300    
 H   -4.604300      0.1188000      -2.623100    
 H   -5.947000       1.454800      -1.022000    


%chk=000132865-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000132865

0 1
S 0.560658 1.596959 0.092982
O 0.466529 2.748161 -1.064549
O -0.258523 1.806364 1.505898
O 1.375819 -2.583189 1.433209
O -1.988382 -2.332470 1.475873
O 2.734096 0.170215 -2.549525
O 4.851216 0.104380 -1.586101
N 1.597561 -0.875185 -0.295203
C 0.365925 -0.275992 -0.759722
C 2.582628 1.220584 0.583145
C -0.455456 -1.383649 -0.040638
C 2.867166 -0.144522 -0.149578
C 0.924805 -1.815917 0.577214
C -1.636136 -1.026693 0.884337
C 2.580221 1.061143 2.101884
C 3.317443 2.447782 0.057048
C 3.611855 0.036763 -1.474185
C -2.801472 -0.431795 0.092061
C -3.105518 0.949779 0.174325
C -3.593524 -1.274103 -0.732080
C -4.185090 1.483056 -0.566874
C -4.671853 -0.739148 -1.468792
C -4.968628 0.643021 -1.390344
H 0.249064 -0.001156 -1.814560
H -0.814898 -2.142425 -0.760849
H 3.522778 -0.748674 0.502857
H -1.306259 -0.312388 1.663029
H 3.621305 1.128548 2.472401
H 1.984803 1.858583 2.579939
H 2.159355 0.094440 2.428080
H 3.097347 3.325615 0.687513
H 4.409504 2.271645 0.073433
H 3.015638 2.699574 -0.975495
H -2.757909 -2.201448 2.085682
H 3.242909 0.326113 -3.391147
H -2.496181 1.600204 0.813304
H -3.373988 -2.347690 -0.769883
H -4.411752 2.552805 -0.500350
H -5.282869 -1.395305 -2.099071
H -5.805488 1.058816 -1.962766


