%chk=000076813.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076813

0 1
 S   0.1638000     -0.5521000       1.722800    
 S   -2.776200     -0.4616000       1.209400    
 S    3.630700     -0.1215000       1.845000    
 P    1.993100     -3.5700001E-02  0.7687000    
 O    2.071400     -0.9033000     -0.6136000    
 O    1.726900       1.452900      0.1455000    
 C   -5.253100     -8.4299996E-02  9.1700003E-02
 C   -3.767200      0.1042000     -0.1933000    
 C   -1.131100     -9.9500000E-02  0.5408000    
 C   -6.100100      0.3915000      -1.079400    
 C    2.298000      -2.302000     -0.5671000    
 C    2.663600       2.045100     -0.7392000    
 C    2.322900      -2.844700      -1.980100    
 C    2.157400       3.411100      -1.151200    
 H   -5.545000      0.4772000      0.9875000    
 H   -5.475200      -1.141900      0.2796000    
 H   -3.481600     -0.4655000      -1.083900    
 H   -3.552500       1.162300     -0.3768000    
 H   -1.053000      0.9693000      0.3247000    
 H  -0.9759000     -0.6644000     -0.3824000    
 H   -5.863100     -0.1698000      -1.989000    
 H   -7.163200      0.2499000     -0.8604000    
 H   -5.933200       1.455100      -1.278000    
 H    3.255000      -2.507300     -7.9499997E-02
 H    1.499500      -2.783200      5.2999998E-03
 H    3.632000       2.147500     -0.2418000    
 H    2.784600       1.409500      -1.621400    
 H    2.495900      -3.924500      -1.981400    
 H    1.375400      -2.638000      -2.488700    
 H    3.110800      -2.359500      -2.565700    
 H    2.856800       3.896700      -1.837400    
 H    1.181300       3.328700      -1.640700    
 H    2.020200       4.052100     -0.2740000    


%chk=000076813-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076813

0 1
S -0.795948 -1.969436 0.896485
S -3.171375 -1.629777 -1.118234
S 2.028247 -0.189472 2.525916
P 1.000640 -0.579330 0.778267
O 1.956382 -1.178254 -0.562667
O 0.263951 0.740317 -0.080367
C -4.605349 0.687113 -0.377843
C -3.173586 0.222274 -0.689260
C -1.353434 -1.966421 -0.945935
C -4.642128 2.197197 -0.046676
C 2.949863 -2.254392 -0.284658
C 1.125175 1.922993 -0.400218
C 3.684626 -2.506978 -1.598168
C 0.201429 2.959034 -1.032431
H -5.000624 0.105358 0.476291
H -5.267076 0.480955 -1.241852
H -2.744447 0.769012 -1.547025
H -2.506355 0.345272 0.181557
H -0.750384 -1.211806 -1.470728
H -1.164423 -2.971419 -1.347700
H -4.275488 2.802207 -0.897188
H -5.672399 2.524306 0.182289
H -4.010125 2.426818 0.831201
H 3.633828 -1.913963 0.516072
H 2.411061 -3.157441 0.063594
H 1.580330 2.291978 0.538761
H 1.923539 1.598743 -1.092988
H 4.435637 -3.306321 -1.457794
H 2.981469 -2.823195 -2.387314
H 4.204975 -1.595010 -1.936761
H 0.779454 3.866642 -1.287135
H -0.253982 2.566055 -1.957569
H -0.604585 3.241241 -0.333921


