%chk=000177955.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177955

0 1
 S    5.244100      0.9853000      0.1367000    
 O   0.4423000      -1.152300      -1.578800    
 O    3.015700      -1.917900      0.1709000    
 O    2.288100     -0.5818000       1.852200    
 C    2.565200      0.3745000     -0.3743000    
 C    1.118500      0.8924000     -0.4811000    
 C    3.508500       1.525800      1.7600000E-02
 C   0.1215000     -0.1857000     -0.8917000    
 C   -1.297800     -4.9400002E-02 -0.4538000    
 C    2.606500     -0.7275000      0.6788000    
 C   -1.815400       1.213500     -0.2757000    
 C   -2.036600      -1.192100     -0.2447000    
 C   -3.917300      0.2016000      0.3536000    
 C   -3.142800       1.340800      0.1336000    
 C   -3.364000      -1.064900      0.1645000    
 C   -5.336300      0.3379000      0.7919000    
 H    2.871600     -4.3800000E-02  -1.341800    
 H   0.8168000       1.306800      0.4887000    
 H    1.067900       1.691600      -1.229800    
 H    3.225200       1.953600      0.9854000    
 H    3.456400       2.323900     -0.7303000    
 H   -1.239900       2.115300     -0.4568000    
 H   -1.617000      -2.183800     -0.3832000    
 H   -3.564300       2.333000      0.2725000    
 H   -3.957300      -1.960000      0.3323000    
 H    5.094100      0.1950000       1.209600    
 H   -5.641500     -0.5114000       1.412700    
 H   -5.478800       1.241800       1.393900    
 H   -5.995500      0.3895000     -8.0200002E-02
 H    3.027200      -2.622200      0.8536000    


%chk=000177955-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177955

0 1
S 5.208227 1.279143 -0.978692
O 0.545137 -1.562035 -0.534676
O 3.985912 -1.565863 0.370050
O 2.489932 -0.816592 1.976193
C 2.568369 0.309082 -0.232133
C 1.105665 0.744833 -0.004836
C 3.527372 1.530126 -0.140919
C 0.116362 -0.408949 -0.228876
C -1.347701 -0.139221 -0.085412
C 2.953000 -0.728719 0.818642
C -1.863381 1.137606 0.265892
C -2.261486 -1.206686 -0.302710
C -4.168818 0.274828 0.172284
C -3.252612 1.336753 0.393523
C -3.646238 -1.001525 -0.174290
C -5.664877 0.500080 0.280297
H 2.673136 -0.159791 -1.225174
H 0.980449 1.126516 1.027445
H 0.853139 1.575182 -0.692627
H 3.687272 1.834270 0.907393
H 3.092715 2.382214 -0.689901
H -1.186063 1.978583 0.449219
H -1.853435 -2.188292 -0.565767
H -3.635437 2.326188 0.670546
H -4.337008 -1.836657 -0.340994
H 5.480158 0.054537 -0.389403
H -6.187595 -0.408511 0.626836
H -5.903683 1.322527 0.976647
H -6.093764 0.768057 -0.705160
H 4.200353 -2.228184 1.082902


