%chk=000007566.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007566

0 1
 S  -0.8873000       2.257000      0.2191000    
 O    4.379400      -1.818100      0.8655000    
 O    5.007900     -0.6972000     -0.9142000    
 N    4.179500     -0.9337000     -1.9000000E-03
 N   -5.015800      -2.036700     -0.3360000    
 C   0.6235000       1.305300      0.1526000    
 C   -2.114200      0.9744000      5.6299999E-02
 C   0.8634000      0.3192000       1.106300    
 C    1.555200       1.553500     -0.8522000    
 C    2.978700     -0.1777000      5.0200000E-02
 C   -2.133000      0.1679000      -1.081700    
 C   -3.058400      0.7800000       1.064600    
 C    2.043100     -0.4234000       1.055000    
 C    2.734800      0.8107000     -0.9034000    
 C   -4.039800      -1.027400     -0.2033000    
 C   -3.095800     -0.8329000      -1.211500    
 C   -4.021100     -0.2209000      0.9347000    
 H   0.1513000      0.1151000       1.901900    
 H    1.381000       2.319500      -1.603600    
 H   -1.412000      0.3053000      -1.883800    
 H   -3.059500       1.398900       1.958500    
 H    2.200100      -1.184300       1.815300    
 H    3.440900       1.029400      -1.700500    
 H   -3.101400      -1.453500      -2.103900    
 H   -4.751900     -0.3623000       1.726900    
 H   -5.026500      -2.625600      -1.158200    
 H   -5.697000      -2.181800      0.3973000    


%chk=000007566-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000007566

0 1
S -0.864543 2.056522 -0.795516
O 4.427772 -1.890688 0.970919
O 5.521848 0.006683 0.324289
N 4.439690 -0.677138 0.519277
N -5.283148 -1.966924 0.308841
C 0.688628 1.174879 -0.381787
C -2.161645 0.801395 -0.443732
C 0.721149 -0.152526 0.114671
C 1.901530 1.890878 -0.579837
C 3.148728 -0.038095 0.209447
C -2.607253 -0.066425 -1.469425
C -2.771629 0.745100 0.832364
C 1.952312 -0.763187 0.412082
C 3.135030 1.287599 -0.285318
C -4.259392 -1.058011 0.061760
C -3.641271 -0.988496 -1.223693
C -3.806576 -0.173608 1.087360
H -0.212559 -0.702121 0.265862
H 1.876144 2.916263 -0.963985
H -2.142986 -0.018559 -2.459963
H -2.435379 1.421736 1.624916
H 2.004032 -1.785558 0.795845
H 4.080373 1.816979 -0.429656
H -3.976597 -1.655514 -2.026699
H -4.270502 -0.207281 2.080252
H -5.610312 -2.595770 -0.418881
H -5.728344 -2.017432 1.220608


