%chk=000007382.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007382

0 1
 S    2.330900     -8.6800002E-02  0.1202000    
 O    2.913300       1.113500      0.7029000    
 O    2.626500      -1.389300      0.7013000    
 O   -3.517100      0.6634000     -6.3800000E-02
 N   -2.466300      -1.946500     -5.9000002E-03
 C   0.5988000      0.1280000      6.5600000E-02
 C  -0.2427000     -0.9843000      5.1500000E-02
 C   5.6899998E-02   1.413000      3.6400001E-02
 C   -1.626200     -0.8117000      8.1000002E-03
 C    2.820700     -0.1583000      -1.588100    
 C   -2.168200      0.4732000     -2.1199999E-02
 C   -1.326600       1.585600     -7.0000002E-03
 H   0.1719000      -1.989300      6.7599997E-02
 H   0.6931000       2.293500      3.9400000E-02
 H    2.542000      0.7771000      -2.076800    
 H    3.904500     -0.2887000      -1.624700    
 H    2.327200      -1.007700      -2.064200    
 H   -1.742400       2.589300     -3.1300001E-02
 H   -3.470000      -1.874400      6.3800000E-02
 H   -2.046400      -2.867200      1.9900000E-02
 H   -3.969300     -0.1819000     -0.2057000    


%chk=000007382-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007382

0 1
S 2.368855 -0.107437 0.151457
O 3.007097 1.231755 0.845011
O 2.606318 -1.614481 0.752951
O -3.614125 0.641303 -0.140787
N -2.715511 -1.855542 0.055435
C 0.504677 0.142162 0.015867
C -0.311432 -1.002012 0.062750
C 0.002251 1.455979 -0.043173
C -1.705453 -0.812921 0.012852
C 3.004704 -0.137842 -1.657447
C -2.240515 0.511207 -0.081418
C -1.393709 1.644319 -0.100430
H 0.136027 -1.996505 0.172760
H 0.688397 2.309153 -0.013344
H 2.756829 0.835769 -2.101643
H 4.089476 -0.290620 -1.569881
H 2.505906 -0.977811 -2.159701
H -1.833159 2.643870 -0.151645
H -2.816207 -2.324340 0.962282
H -2.683986 -2.525683 -0.719432
H -3.945841 -0.319823 -0.104463


