%chk=000013720.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013720

0 1
 S    1.378100       1.984100      0.4315000    
 O   -4.758000     -0.3142000     -0.9211000    
 O   -4.202600      -1.697200      0.6906000    
 N   -3.940600     -0.7301000     -6.4700000E-02
 C  -0.2039000       1.176900      0.2839000    
 C    2.493700      0.6328000      8.1299998E-02
 C   -1.128500       1.621800     -0.6609000    
 C  -0.5174000      0.1001000       1.113200    
 C   -2.680200     -8.6800002E-02  5.2800000E-02
 C   -2.366800      0.9900000     -0.7764000    
 C   -1.755500     -0.5319000      0.9977000    
 C    2.427100     -2.0600000E-02  -1.146500    
 C    3.425900      0.2387000       1.037900    
 C    3.298300      -1.075200      -1.419900    
 C    4.297100     -0.8157000      0.7647000    
 C    4.233300      -1.472700     -0.4642000    
 H  -0.9012000       2.459200      -1.316200    
 H   0.1849000     -0.2600000       1.861100    
 H   -3.062200       1.363600      -1.523700    
 H   -1.965900      -1.366700       1.661300    
 H    1.711100      0.2761000      -1.908700    
 H    3.489400      0.7387000       2.001100    
 H    3.249700      -1.585900      -2.377100    
 H    5.025100      -1.125600       1.508700    
 H    4.911900      -2.293600     -0.6769000    


%chk=000013720-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013720

0 1
S 1.362825 1.884744 -0.611478
O -5.180738 0.272743 0.261069
O -4.253380 -1.740089 0.812249
N -4.161341 -0.505432 0.435110
C -0.257577 1.095721 -0.279184
C 2.556124 0.500760 -0.335719
C -1.405694 1.915236 -0.458423
C -0.403331 -0.251141 0.137296
C -2.816392 0.047537 0.189207
C -2.688787 1.394254 -0.224653
C -1.685555 -0.779372 0.372640
C 2.887209 -0.360246 -1.407287
C 3.179672 0.361594 0.925298
C 3.847298 -1.379461 -1.207920
C 4.141165 -0.658499 1.116018
C 4.473922 -1.528802 0.051760
H -1.292729 2.955507 -0.781523
H 0.477748 -0.883833 0.277507
H -3.586330 2.003899 -0.356586
H -1.824891 -1.814686 0.694809
H 2.402650 -0.231774 -2.380387
H 2.917375 1.041779 1.741789
H 4.106266 -2.048905 -2.035103
H 4.627206 -0.769052 2.091204
H 5.220085 -2.316682 0.201810


