%chk=000176790.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176790

0 1
 S  -0.4524000       2.724700     -0.7797000    
 S   -4.343800      -1.005100      0.5998000    
 S    2.660300     -0.5222000       2.144700    
 P    2.613800     -0.4397000      0.1967000    
 O    1.347800      0.3167000     -0.4769000    
 O    3.855900      0.3395000     -0.5119000    
 O    2.634500      -1.852000     -0.6109000    
 C   -2.280500      0.7506000     -7.9599999E-02
 C  -0.9431000       1.056100     -0.3319000    
 C   2.4800001E-02  5.9500001E-02 -0.2378000    
 C   -2.645400     -0.5507000      0.2661000    
 C  -0.3356000      -1.240700      0.1071000    
 C   -1.673000      -1.546300      0.3595000    
 C   -3.331000       1.816900     -0.1812000    
 C  -0.1208000       3.446800      0.8492000    
 C   -4.634800      -2.271100     -0.6657000    
 C    4.001100       1.739400     -0.3399000    
 C    3.622300      -2.822300     -0.3077000    
 H   0.3822000      -2.047700      0.1856000    
 H   -1.928600      -2.566700      0.6345000    
 H   -3.411000       2.356300      0.7683000    
 H   -3.124200       2.534900     -0.9806000    
 H   -4.319900       1.431000     -0.4428000    
 H   -1.020600       3.421600       1.469400    
 H   0.1915000       4.487000      0.7262000    
 H   0.6800000       2.897700       1.351700    
 H   -4.401700      -1.877700      -1.658900    
 H   -5.688700      -2.561300     -0.6446000    
 H   -4.028800      -3.160300     -0.4747000    
 H    4.886200       2.067600     -0.8904000    
 H    4.133400       1.980300      0.7175000    
 H    3.126100       2.261300     -0.7349000    
 H    3.657200      -3.550300      -1.122000    
 H    3.360600      -3.340300      0.6182000    
 H    4.604300      -2.351800     -0.2105000    


%chk=000176790-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176790

0 1
S 0.003746 2.649129 -0.473561
S -4.595838 -0.579053 0.023940
S 2.355166 0.054489 2.022609
P 2.624240 -0.326649 0.006922
O 1.331252 -0.011691 -1.121642
O 3.913122 0.478453 -0.799433
O 2.973461 -1.951521 -0.447996
C -2.223969 0.859670 -0.277232
C -0.822116 0.995610 -0.495052
C -0.036080 -0.153508 -0.773605
C -2.788869 -0.454287 -0.299869
C -0.609004 -1.438808 -0.806766
C -1.985779 -1.588131 -0.559128
C -3.116803 2.059565 -0.035579
C -0.071944 3.027742 1.382161
C -4.928418 -2.408372 -0.231417
C 4.014985 1.952161 -0.643623
C 3.984596 -2.695468 0.341273
H 0.028851 -2.301079 -1.024166
H -2.417124 -2.592347 -0.579198
H -3.442017 2.113788 1.021825
H -2.593957 2.994854 -0.292589
H -4.035096 1.991820 -0.648265
H -1.117082 3.055062 1.724513
H 0.389452 4.020872 1.503806
H 0.504660 2.265103 1.926697
H -4.655862 -2.715233 -1.253131
H -6.014306 -2.522879 -0.090573
H -4.396038 -3.014494 0.517894
H 4.936374 2.220475 -1.180524
H 4.096516 2.221976 0.425385
H 3.136960 2.443245 -1.096702
H 3.915166 -3.729398 -0.027083
H 3.747684 -2.652506 1.420198
H 4.992169 -2.286890 0.151813


