%chk=000126394.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126394

0 1
 S    4.462600      -1.140800     -8.7700002E-02
 O    4.070400      0.4538000     -0.1745000    
 O   -2.245100      1.5200000E-02   1.334200    
 O    6.095100      -1.141900     -9.1100000E-02
 O    4.018800      -1.667400       1.189800    
 O    4.026500      -1.769400      -1.321100    
 O   -3.535300      -2.357100      1.1200000E-02
 O   -4.964200      -1.185600       1.335400    
 N   -3.231800      0.7124000     -0.6565000    
 C   7.9999998E-02   1.561900      0.1035000    
 C   -1.353400       1.960300      0.2036000    
 C   0.8595000       1.467300       1.256300    
 C   0.6412000       1.284100      -1.142900    
 C    2.761900      0.8170000     -8.3700001E-02
 C    2.200400       1.094900       1.162600    
 C    1.982200      0.9116000      -1.236600    
 C   -2.308800      0.7868000      0.3800000    
 C   -4.198400     -0.2459000     -0.7411000    
 C   -4.294900      -1.278600      0.3178000    
 C   -5.066900     -0.2784000      -1.759100    
 H   -1.627100       2.564600     -0.6701000    
 H   -1.502500       2.625900       1.064000    
 H   0.4340000       1.679700       2.233500    
 H   4.3499999E-02   1.352700      -2.048000    
 H    2.802300       1.024800       2.064600    
 H    2.413200      0.6980000      -2.210900    
 H   -3.197200       1.401900      -1.403100    
 H   -5.034100      0.4572000      -2.556600    
 H   -5.835000      -1.042900      -1.821900    
 H    6.515100     -0.5672000     -0.7734000    
 H   -3.587200      -3.051100      0.7026000    


%chk=000126394-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126394

0 1
S 4.292333 -1.728717 -0.376094
O 3.846300 0.201455 0.387383
O -2.803885 1.122169 1.425799
O 6.049944 -1.210311 -0.347400
O 4.169722 -3.028007 0.569079
O 3.744268 -1.805242 -1.895541
O -2.364397 -1.615523 0.491484
O -4.584134 -2.177749 0.916789
N -3.130406 0.683292 -0.838737
C -0.028984 1.764181 -0.049863
C -1.424139 2.359520 -0.191775
C 0.394410 1.225370 1.201755
C 0.860924 1.735407 -1.160066
C 2.575589 0.667741 0.227082
C 1.672246 0.667977 1.338737
C 2.149637 1.192719 -1.035059
C -2.512291 1.347948 0.219286
C -4.071022 -0.372416 -0.651275
C -3.742828 -1.450451 0.346852
C -5.200134 -0.491829 -1.398178
H -1.581073 2.724741 -1.222531
H -1.536237 3.220633 0.492115
H -0.302060 1.235098 2.046689
H 0.536984 2.144698 -2.123991
H 2.013852 0.241619 2.287526
H 2.841405 1.157136 -1.882425
H -2.922891 0.975017 -1.795510
H -5.489075 0.261552 -2.138134
H -5.850365 -1.359000 -1.259804
H 6.007392 -0.222845 -0.171370
H -2.186284 -2.322384 1.167978


