%chk=000126050.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126050

0 1
 S   -7.569000      -1.248000     -0.1341000    
 O    3.237700     -0.4752000      0.3379000    
 O    2.175000       1.522700     -0.2293000    
 O    6.905200       1.002200     -0.7753000    
 O    4.433800       2.270300      -1.753600    
 O    6.509100      -1.866200     -0.5229000    
 O    4.899800      -3.521300      0.8722000    
 O    3.333200      -2.362600       2.055000    
 O   0.5775000     -0.1352000     -0.2921000    
 O   -6.255300      0.9561000       1.300600    
 C    5.656900      0.3391000     -0.9810000    
 C    4.510400       1.310700     -0.6996000    
 C    5.604600     -0.8707000     -4.7499999E-02
 C    3.170800      0.5780000     -0.6201000    
 C    4.201300      -1.463000     -9.3000000E-03
 C    4.074500      -2.468300       1.089200    
 C  -4.6100002E-02   2.153700      0.2903000    
 C   0.9043000       1.028900     -0.1000000    
 C   -1.487900       1.676700      0.3550000    
 C   0.4047000       2.815400       1.595600    
 C   -2.410300       2.216300     -0.5194000    
 C   -1.834300      0.7170000       1.285200    
 C   -3.733400       1.778300     -0.4612000    
 C   -3.157300      0.2788000       1.343400    
 C   -4.106800      0.8096000      0.4702000    
 C   -5.486500      0.3537000      0.5325000    
 C   -5.949100     -0.7950000     -0.2751000    
 C   -5.217100      -1.537000      -1.126800    
 C   -6.022500      -2.554000      -1.715900    
 C   -7.323000      -2.510800      -1.264000    
 H    5.641400      2.8200001E-02  -2.033100    
 H    4.697700       1.865900      0.2280000    
 H    5.938900     -0.5815000      0.9565000    
 H    2.893300      0.1791000      -1.605700    
 H    3.911400      -1.947000     -0.9503000    
 H    7.610500      0.3566000     -0.9533000    
 H    5.299300       2.710500      -1.808600    
 H    6.223800      -2.132300      -1.413700    
 H   3.2400001E-02   2.901500     -0.5111000    
 H   0.4935000       2.088500       2.410700    
 H    1.385700       3.289000       1.479100    
 H  -0.3030000       3.590900       1.908700    
 H    4.832500      -4.192600       1.584400    
 H   -2.132100       2.970800      -1.248900    
 H   -1.107400      0.2938000       1.971700    
 H   -4.465000       2.199100      -1.146200    
 H   -3.437100     -0.4764000       2.073500    
 H   -4.166700      -1.398300      -1.347400    
 H   -5.666200      -3.280400      -2.434600    
 H   -8.140500      -3.160400      -1.543300    


%chk=000126050-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126050

0 1
S -7.599255 -0.050583 -1.805235
O 4.016764 0.037219 0.970148
O 1.903466 0.877543 0.541770
O 5.034496 0.345407 -3.077090
O 2.273767 0.373554 -2.300720
O 6.724731 -1.213164 -1.353680
O 7.378661 -1.313848 1.289492
O 5.960306 -0.374495 2.877331
O 0.848439 -0.938739 1.579693
O -6.022590 2.278409 -0.676835
C 4.596419 -0.273615 -1.825553
C 3.375167 0.536836 -1.359094
C 5.728212 -0.307972 -0.787285
C 2.909690 -0.008609 -0.004835
C 5.134785 -0.816369 0.566410
C 6.133903 -0.780986 1.722122
C -0.041786 1.357761 1.885997
C 0.907828 0.286473 1.357610
C -1.397530 1.276934 1.170467
C -0.201279 1.194318 3.423941
C -1.953683 2.439162 0.577315
C -2.139455 0.068730 1.135081
C -3.221395 2.398309 -0.033126
C -3.399803 0.019973 0.506433
C -3.954533 1.184072 -0.090055
C -5.318897 1.215431 -0.720823
C -5.829986 0.011434 -1.404817
C -5.168448 -1.110423 -1.915393
C -6.030395 -2.031403 -2.600448
C -7.358386 -1.619192 -2.619881
H 4.282172 -1.325317 -2.011370
H 3.662696 1.602539 -1.248160
H 6.141336 0.711876 -0.638377
H 2.510267 -1.040671 -0.085770
H 4.811232 -1.873788 0.422419
H 5.831124 -0.150705 -3.397281
H 2.622143 0.603275 -3.201110
H 7.425374 -1.370082 -0.664131
H 0.415433 2.336981 1.666007
H -0.605742 0.197918 3.669359
H 0.771223 1.309264 3.934542
H -0.895487 1.960697 3.808725
H 8.021801 -1.317513 2.048787
H -1.389398 3.378907 0.595996
H -1.723684 -0.835092 1.593832
H -3.666591 3.297251 -0.471734
H -3.971960 -0.913259 0.517966
H -4.088229 -1.246157 -1.830169
H -5.683171 -2.958054 -3.063126
H -8.217149 -2.125039 -3.059048


