%chk=000097180.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097180

0 1
 S    1.598700     -7.7100001E-02   1.007900    
 O    1.480600      -1.384900       1.630400    
 O    1.437500       1.127800       1.804200    
 C   0.4701000      1.3000000E-02 -0.3443000    
 C  -0.9893000     -2.6500000E-02  9.4099998E-02
 C   -2.010500     -1.9000000E-03  -1.050700    
 C    3.191900     -1.3600000E-02  0.2430000    
 C   -3.446700      1.0600000E-02 -0.5909000    
 C    3.793000       1.215700      3.7300002E-02
 C    3.806100      -1.193900     -0.1364000    
 C   -4.110100      -1.191600     -0.3964000    
 C   -4.080600       1.224000     -0.3703000    
 C    5.049000       1.266200     -0.5675000    
 C    5.062200      -1.143500     -0.7410000    
 C   -5.438600      -1.180000      2.8600000E-02
 C   -5.409000       1.235700      5.4699998E-02
 C    5.683500      8.6599998E-02 -0.9566000    
 C   -6.088100      3.3599999E-02  0.2540000    
 H   0.6851000     -0.8315000      -1.007200    
 H   0.6744000      0.9429000     -0.8850000    
 H   -1.158300     -0.9256000      0.7013000    
 H   -1.181500      0.8212000      0.7650000    
 H   -1.845900     -0.8682000      -1.704900    
 H   -1.827300      0.8769000      -1.682900    
 H    3.311500       2.144600      0.3263000    
 H    3.335400      -2.160300      1.4900000E-02
 H   -3.612100      -2.141800     -0.5674000    
 H   -3.559700       2.165200     -0.5208000    
 H    5.532100       2.224000     -0.7371000    
 H    5.555700      -2.061700      -1.046100    
 H   -5.967200      -2.115900      0.1845000    
 H   -5.914700       2.180600      0.2310000    
 H    6.661000      0.1259000      -1.428400    
 H   -7.122400      4.2700000E-02  0.5852000    


%chk=000097180-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097180

0 1
S 1.596300 -0.046913 0.978712
O 1.368831 -1.536725 1.624459
O 1.430288 1.323688 1.862588
C 0.364059 0.102773 -0.518488
C -1.067556 0.035665 0.010930
C -2.093784 0.127274 -1.159348
C 3.326002 -0.022183 0.190567
C -3.527740 0.060895 -0.650998
C 3.956961 1.220990 0.022466
C 3.917895 -1.254364 -0.130287
C -4.133817 -1.188930 -0.360772
C -4.271405 1.245286 -0.416044
C 5.256219 1.224652 -0.537795
C 5.217826 -1.230077 -0.688245
C -5.448507 -1.254660 0.151666
C -5.587120 1.184735 0.097036
C 5.878285 0.004593 -0.896009
C -6.180133 -0.066379 0.383231
H 0.636343 -0.742499 -1.172421
H 0.626594 1.069404 -0.979377
H -1.218290 -0.911892 0.560777
H -1.244297 0.862643 0.723527
H -1.901544 -0.701445 -1.869077
H -1.929572 1.073134 -1.710946
H 3.461513 2.142163 0.347847
H 3.391004 -2.191484 0.079894
H -3.573566 -2.115527 -0.540355
H -3.817819 2.219644 -0.637592
H 5.782399 2.173879 -0.683408
H 5.714641 -2.170306 -0.949437
H -5.902082 -2.228439 0.368535
H -6.148298 2.109829 0.271217
H 6.886484 0.015124 -1.324359
H -7.200312 -0.115348 0.780009


