%chk=000019577.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019577

0 1
 S   -4.227400      0.2330000      0.1217000    
 S    2.652300      0.4656000      -2.158500    
 P    2.800600      2.5100000E-02 -0.2644000    
 O    1.612600     -0.8727000      0.3767000    
 O    4.111800     -0.8407000      0.1637000    
 O    2.893300       1.264900      0.7851000    
 O   -4.944200     -0.9769000      0.6791000    
 C   -1.538000      0.9783000      0.1947000    
 C   -2.456200     -7.1599998E-02  0.1981000    
 C   0.2708000     -0.6083000      0.3186000    
 C  -0.1707000      0.7093000      0.2552000    
 C   -2.007100      -1.390600      0.2621000    
 C  -0.6398000      -1.659800      0.3226000    
 C   -1.976300       2.405600      0.1268000    
 C   -4.469300      0.2218000      -1.676400    
 C    4.247400      -2.181200     -0.2780000    
 C    3.840100       2.298200      0.5729000    
 H   0.5276000       1.538300      0.2588000    
 H   -2.700900      -2.227100      0.2608000    
 H  -0.2938000      -2.688400      0.3705000    
 H   -1.127900       3.096300      0.1921000    
 H   -2.483700       2.610400     -0.8209000    
 H   -2.644000       2.646600      0.9605000    
 H   -4.140100     -0.7355000      -2.087500    
 H   -3.903300       1.038600      -2.129100    
 H   -5.533200      0.3600000      -1.883400    
 H    5.168800      -2.593800      0.1405000    
 H    4.308600      -2.215600      -1.368400    
 H    3.402400      -2.781700      6.7900002E-02
 H    3.952000       2.864300       1.500900    
 H    3.484200       2.971300     -0.2108000    
 H    4.810300       1.877600      0.2952000    


%chk=000019577-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019577

0 1
S -4.442198 0.104136 0.145794
S 2.654739 0.106124 -2.268081
P 2.827021 -0.095144 -0.225803
O 1.549694 -0.887484 0.653424
O 4.163994 -0.991468 0.381603
O 2.972663 1.335160 0.724579
O -4.997027 -1.471693 0.276393
C -1.670903 1.026386 0.299589
C -2.537703 -0.090363 0.234446
C 0.174111 -0.580971 0.466104
C -0.285261 0.753679 0.423722
C -2.092959 -1.419871 0.308013
C -0.711107 -1.677385 0.410216
C -2.169054 2.460007 0.237327
C -4.540271 0.445102 -1.751777
C 4.538717 -2.256449 -0.294655
C 4.016045 2.319399 0.342813
H 0.433206 1.576810 0.508589
H -2.846013 -2.219710 0.289339
H -0.315537 -2.695554 0.460865
H -1.441669 3.149237 0.697649
H -2.314302 2.789740 -0.809959
H -3.133738 2.584497 0.762009
H -4.036716 -0.401243 -2.239586
H -4.051762 1.404441 -1.979059
H -5.613088 0.467414 -1.992490
H 5.521784 -2.513563 0.125565
H 4.611455 -2.110734 -1.388124
H 3.802345 -3.043817 -0.059213
H 3.799856 3.204719 0.958227
H 3.944195 2.569687 -0.731792
H 5.016383 1.920211 0.581372


