%chk=000065111.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065111

0 1
 S    5.478800     -0.3537000     -0.4054000    
 O    5.555700      -1.503000      0.5510000    
 C   -1.124800      0.5116000      0.1628000    
 C   0.1491000     -0.2132000     -0.2783000    
 C   -2.404700     -0.2768000     -0.1351000    
 C    1.427400      0.5823000      9.3999999E-03
 C   -3.716400      0.4068000      0.2637000    
 C    2.707200     -0.1787000     -0.3564000    
 C   -4.962000     -0.4003000     -0.1076000    
 C   -6.240300      0.3677000      0.2313000    
 C    3.976700      0.5858000      4.9000001E-03
 C   -7.482200     -0.4423000     -0.1052000    
 C    6.635500      0.9137000      0.1649000    
 H   -1.072900      0.7149000       1.239400    
 H   -1.179100       1.484300     -0.3411000    
 H   0.2041000      -1.181400      0.2343000    
 H   9.3400002E-02 -0.4259000      -1.352900    
 H   -2.436800     -0.4933000      -1.210700    
 H   -2.347000      -1.247800      0.3732000    
 H    1.456300      0.8368000       1.076100    
 H    1.397800       1.529600     -0.5426000    
 H   -3.763100       1.388200     -0.2246000    
 H   -3.709900      0.5919000       1.344900    
 H    2.705700      -1.147800      0.1586000    
 H    2.701600     -0.3992000      -1.431400    
 H   -4.948900      -1.357600      0.4270000    
 H   -4.946100     -0.6285000      -1.180200    
 H   -6.265500       1.313000     -0.3230000    
 H   -6.253000      0.6167000       1.298800    
 H    4.011700       1.532300     -0.5446000    
 H    3.995000      0.8068000       1.077400    
 H   -7.516200     -0.6827000      -1.172600    
 H   -7.504000      -1.380000      0.4593000    
 H   -8.384100      0.1253000      0.1442000    
 H    6.514900       1.816900     -0.4378000    
 H    7.653300      0.5344000      4.5899998E-02
 H    6.454700       1.138600       1.218700    


%chk=000065111-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065111

0 1
S 5.560228 -0.363335 -0.467879
O 5.238837 -1.640777 0.572211
C -1.136032 0.552283 0.048382
C 0.168129 -0.168108 -0.361216
C -2.406369 -0.284597 -0.223498
C 1.435364 0.682014 -0.114646
C -3.710310 0.426053 0.204388
C 2.734405 -0.070972 -0.493634
C -4.982595 -0.402661 -0.082770
C -6.286204 0.306657 0.350016
C 3.981541 0.784349 -0.267940
C -7.552706 -0.525277 0.053597
C 6.757359 0.764255 0.537354
H -1.090181 0.807613 1.127923
H -1.210055 1.517053 -0.496447
H 0.253289 -1.121573 0.199648
H 0.113897 -0.442453 -1.435448
H -2.459863 -0.528063 -1.305430
H -2.326982 -1.255404 0.309069
H 1.479703 0.970538 0.956124
H 1.361589 1.626536 -0.693010
H -3.783957 1.402758 -0.318859
H -3.661722 0.658316 1.289118
H 2.829117 -0.988073 0.121873
H 2.678912 -0.393815 -1.552695
H -4.909695 -1.381061 0.437133
H -5.034645 -0.631825 -1.168009
H -6.355772 1.286051 -0.166332
H -6.235068 0.531082 1.435227
H 4.109854 1.600356 -1.000573
H 4.038165 1.171800 0.764560
H -7.643964 -0.735770 -1.028908
H -7.520219 -1.497424 0.581223
H -8.470069 0.002335 0.373877
H 6.815506 1.758071 0.065940
H 7.733806 0.258993 0.528081
H 6.348605 0.809476 1.557846


