%chk=000132382.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132382

0 1
 S    6.604900     -0.5283000       1.071500    
 O   0.8088000     -0.3983000     -0.1886000    
 O  -0.6018000      0.5993000      -3.603600    
 O    1.182400       1.616000      -1.309300    
 C   -1.073200      0.6714000      -1.212400    
 C   -1.862200       1.313700     -0.1165000    
 C   -2.755800      0.5781000      0.6641000    
 C   -1.353500       1.281000      -2.604200    
 C   -1.689500       2.678000      0.1163000    
 C   -2.954000     -0.8378000      0.4425000    
 C   0.4366000      0.7202000     -0.9336000    
 C   -3.476400       1.211800       1.678100    
 C   -2.410500       3.309300       1.129800    
 C   -3.303900       2.576300       1.910700    
 C   -3.935200      -1.274300     -0.4477000    
 C   -2.162400      -1.766600       1.118000    
 C   -4.124600      -2.639400     -0.6627000    
 C   -2.351800      -3.131800      0.9030000    
 C    2.173200     -0.4285000      0.1078000    
 C   -3.332900      -3.568200      1.2800000E-02
 C    2.611700      0.1679000       1.269500    
 C    3.028200      -1.054200     -0.7725000    
 C    3.974300      0.1371000       1.565900    
 C    4.390900      -1.084900     -0.4761000    
 C    4.864000     -0.4892000      0.6931000    
 C    7.312700      0.3414000     -0.3559000    
 H   -1.295400     -0.3953000      -1.331200    
 H   -2.414800       1.179900      -2.856300    
 H   -1.098000       2.344500      -2.660400    
 H  -0.9963000       3.270300     -0.4747000    
 H   -4.177600      0.6569000       2.297300    
 H   -2.275400       4.371400       1.312000    
 H   -3.864900       3.068000       2.700100    
 H   -4.560000     -0.5634000     -0.9834000    
 H   -1.392200      -1.443500       1.814600    
 H   0.3350000      0.8257000      -3.477300    
 H   -4.888000      -2.979200      -1.356300    
 H   -1.734800      -3.854900       1.428400    
 H   -3.480100      -4.631100     -0.1549000    
 H    1.918700      0.6545000       1.948700    
 H    2.659300      -1.519500      -1.681100    
 H    4.324200      0.6069000       2.481900    
 H    5.064300      -1.585000      -1.167600    
 H    7.162000     -0.2329000      -1.273400    
 H    8.387200      0.4693000     -0.1999000    
 H    6.855400       1.328600     -0.4648000    


%chk=000132382-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000132382

0 1
S 6.573062 -0.584964 1.636932
O 0.885707 0.068499 -0.394271
O -1.201363 0.524851 -4.054465
O 1.068641 1.164150 -2.461519
C -1.157973 0.575943 -1.547816
C -1.777212 1.250296 -0.320089
C -2.684339 0.571751 0.551464
C -1.719769 1.191725 -2.864249
C -1.514377 2.629578 -0.110030
C -2.991178 -0.890660 0.449370
C 0.368625 0.657402 -1.549699
C -3.320842 1.317816 1.582241
C -2.137150 3.348564 0.930275
C -3.057858 2.689134 1.775498
C -4.341342 -1.333939 0.415411
C -1.957332 -1.868290 0.448303
C -4.651111 -2.710810 0.367554
C -2.267668 -3.245257 0.403929
C 2.273820 -0.016924 -0.048204
C -3.614885 -3.673062 0.360515
C 2.491468 -0.539827 1.246982
C 3.358371 0.350475 -0.874396
C 3.803718 -0.698052 1.724188
C 4.674440 0.186746 -0.382498
C 4.910185 -0.334832 0.910037
C 7.708125 0.007860 0.266560
H -1.418571 -0.498130 -1.553618
H -2.810743 1.038432 -2.887406
H -1.511724 2.281034 -2.890441
H -0.808232 3.146619 -0.771849
H -4.007634 0.796207 2.258295
H -1.911438 4.410373 1.077176
H -3.554471 3.233372 2.586221
H -5.148644 -0.592229 0.405822
H -0.912127 -1.544134 0.508864
H -0.235355 0.750463 -4.115824
H -5.698266 -3.031677 0.330822
H -1.457493 -3.983082 0.409029
H -3.854121 -4.741595 0.322755
H 1.631104 -0.809392 1.866716
H 3.188089 0.759207 -1.870427
H 3.968271 -1.101977 2.728888
H 5.505759 0.475714 -1.032429
H 7.581809 -0.606739 -0.638373
H 8.728535 -0.121895 0.658590
H 7.532089 1.072457 0.046863


