%chk=000079322.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079322

0 1
 S    1.249800       1.516600      3.6800001E-02
 O    1.471800       2.177100       1.316600    
 O    1.407400       2.267300      -1.201100    
 O   -4.782200     -0.9862000       1.185900    
 O   -4.948300     -0.9969000      -1.081100    
 C  -0.3652000      0.8542000      8.1000002E-03
 C    2.408400      0.1752000      6.3999998E-03
 C   -1.002800      0.6237000      -1.211000    
 C   -1.018700      0.5567000       1.204100    
 C    2.854300     -0.2984000      -1.212700    
 C    2.838900     -0.3664000       1.202400    
 C   -2.947000     -0.2018000     -3.8500000E-02
 C   -2.293700      9.5799997E-02  -1.234300    
 C   -2.309600      2.8600000E-02   1.180700    
 C    3.765500      -1.354200      -1.236600    
 C    3.750300      -1.422200       1.178300    
 C    4.213500      -1.916100     -4.1299999E-02
 C   -4.292500     -0.7530000     -6.2799998E-02
 H  -0.5113000      0.8398000      -2.155400    
 H  -0.5381000      0.7230000       2.164100    
 H    2.511300      0.1215000      -2.153000    
 H    2.483600     -3.7000000E-03   2.161700    
 H   -2.772300     -7.8299999E-02  -2.194500    
 H   -2.780900     -0.1899000       2.134800    
 H    4.124800      -1.740200      -2.186100    
 H    4.097400      -1.861600       2.108900    
 H    4.922200      -2.738900     -5.9999999E-02
 H   -5.689500      -1.358300       1.158400    


%chk=000079322-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079322

0 1
S 1.296800 1.597034 0.040619
O 1.463361 2.309513 1.505681
O 1.466318 2.390256 -1.381814
O -4.937204 -1.007449 1.196887
O -5.031788 -1.023045 -1.124263
C -0.446117 0.828741 0.018537
C 2.496274 0.123514 0.001390
C -1.057017 0.616482 -1.227923
C -1.067136 0.574617 1.251341
C 2.936054 -0.330992 -1.251391
C 2.936319 -0.396875 1.228152
C -3.015050 -0.211264 -0.008568
C -2.361797 0.082187 -1.234325
C -2.373435 0.041210 1.231846
C 3.855651 -1.406002 -1.269435
C 3.855952 -1.471294 1.188823
C 4.306173 -1.975627 -0.054625
C -4.394437 -0.773258 -0.074171
H -0.537707 0.888923 -2.152334
H -0.553581 0.815155 2.187837
H 2.595495 0.157127 -2.170590
H 2.595654 0.041563 2.172013
H -2.891464 -0.106674 -2.173347
H -2.903115 -0.174659 2.163171
H 4.223674 -1.789080 -2.226841
H 4.224277 -1.904657 2.124438
H 5.020207 -2.806025 -0.076772
H -5.855261 -1.376021 1.094462


