%chk=000083701.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083701

0 1
 S   -5.647700       1.061400      0.5107000    
 O   -7.229200      -2.404700     -0.2523000    
 O   -8.182700     -0.4411000      0.3809000    
 C    2.189400      4.6599999E-02  0.2515000    
 C    3.538400      0.5076000     -0.3071000    
 C    1.002900      0.8568000     -0.2835000    
 C    4.731400     -0.2540000      0.2800000    
 C  -0.3490000      0.3825000      0.2565000    
 C    6.075300      0.1518000     -0.3293000    
 C   -1.533700       1.188100     -0.2898000    
 C    7.228000     -0.6328000      0.3018000    
 C   -2.878700      0.7682000      0.3142000    
 C    8.568100     -0.2586000     -0.3312000    
 C   -4.065200       1.569300     -0.2228000    
 C    9.711200      -1.060300      0.2702000    
 C   -5.932800     -0.4206000     -0.4835000    
 C   -7.225700      -1.060300     -6.6299997E-02
 H    2.042900      -1.013000      8.3999997E-03
 H    2.207800      0.1212000       1.345800    
 H    3.533400      0.3868000      -1.397400    
 H    3.666400       1.578800     -0.1078000    
 H    1.143800       1.913600     -2.5300000E-02
 H   0.9927000      0.7968000      -1.378800    
 H    4.759600     -9.0800002E-02   1.364500    
 H    4.578000      -1.329400      0.1261000    
 H  -0.3401000      0.4519000       1.351200    
 H  -0.4888000     -0.6765000      6.8000001E-03
 H    6.235800       1.226500     -0.1818000    
 H    6.053900     -2.7500000E-02  -1.411000    
 H   -1.574400       1.075000      -1.380000    
 H   -1.369000       2.253500     -8.6599998E-02
 H    7.261700     -0.4353000       1.380200    
 H    7.051500      -1.708000      0.1757000    
 H   -3.023700     -0.2997000      0.1135000    
 H   -2.825100      0.8823000       1.404500    
 H    8.533500     -0.4396000      -1.411800    
 H    8.762000      0.8107000     -0.1873000    
 H   -4.126300       1.495900      -1.313800    
 H   -3.921500       2.628400      1.7600000E-02
 H    9.793600     -0.8791000       1.346700    
 H    10.65990     -0.7760000     -0.1957000    
 H    9.563600      -2.133500      0.1125000    
 H   -5.119700      -1.131100     -0.3132000    
 H   -5.995500     -0.1710000      -1.546200    
 H   -8.081200      -2.809200      1.7300000E-02


%chk=000083701-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083701

0 1
S -5.770975 1.208655 0.452410
O -7.595173 -2.252785 -0.631445
O -8.248415 -0.553736 0.816257
C 2.192915 0.052516 0.241071
C 3.563612 0.499236 -0.315577
C 1.005844 0.855079 -0.337675
C 4.749091 -0.315471 0.249232
C -0.360812 0.427326 0.243215
C 6.121837 0.145510 -0.290943
C -1.550804 1.215942 -0.349975
C 7.307088 -0.676556 0.263657
C -2.909602 0.802803 0.266167
C 8.680413 -0.207188 -0.269118
C -4.089285 1.577761 -0.345057
C 9.858726 -1.036797 0.285424
C -5.982744 -0.545276 -0.202720
C -7.381471 -1.055728 0.075182
H 2.044620 -1.026788 0.026995
H 2.197560 0.151491 1.346869
H 3.555608 0.414224 -1.422591
H 3.717419 1.575074 -0.088384
H 1.164411 1.936230 -0.141503
H 0.989129 0.739041 -1.441705
H 4.748861 -0.242847 1.357140
H 4.602884 -1.389565 0.009050
H -0.347409 0.559412 1.345153
H -0.512882 -0.657321 0.061850
H 6.271534 1.217208 -0.042159
H 6.119520 0.082096 -1.399499
H -1.577581 1.066295 -1.449650
H -1.388875 2.301708 -0.186065
H 7.307098 -0.619868 1.372564
H 7.163237 -1.747478 0.008129
H -3.055768 -0.286705 0.121059
H -2.890809 0.976250 1.359732
H 8.677882 -0.260199 -1.377157
H 8.824853 0.861768 -0.010145
H -4.180786 1.392515 -1.431294
H -3.965793 2.665520 -0.195594
H 9.900319 -0.976477 1.389541
H 10.828145 -0.680313 -0.109155
H 9.754731 -2.104156 0.012790
H -5.260749 -1.226787 0.281007
H -5.796083 -0.564160 -1.290188
H -8.506522 -2.595858 -0.422798


