%chk=000115347.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115347

0 1
 S    1.516800     -7.9999998E-04   1.278200    
 O   -4.029500      6.0000003E-04 -0.8286000    
 N    4.756800      8.9999998E-04  -1.167900    
 C    2.493000       0.000000     -0.2521000    
 C  -0.1492000     -3.9999999E-04  0.6454000    
 C    3.982200     -1.9999999E-04  6.9600001E-02
 C  -0.8011000       1.207800      0.3983000    
 C  -0.8013000      -1.208200      0.3972000    
 C   -2.105100       1.208100     -9.6799999E-02
 C   -2.105200      -1.208000     -9.8200001E-02
 C   -2.757200      1.9999999E-04 -0.3453000    
 H    2.227800     -0.8864000     -0.8393000    
 H    2.229300      0.8867000     -0.8395000    
 H    4.252400      0.8883000      0.6513000    
 H    4.253500     -0.8848000      0.6572000    
 H  -0.3089000       2.159100      0.5852000    
 H  -0.3091000      -2.159600      0.5833000    
 H   -2.607800       2.152300     -0.2874000    
 H   -2.602100      -2.155700     -0.2876000    
 H    4.542500     -0.8368000      -1.707600    
 H    5.749800     -4.9699999E-02 -0.9444000    
 H   -4.324100     -0.9196000     -0.9411000    


%chk=000115347-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115347

0 1
S 1.540781 -0.240807 1.344621
O -4.108159 0.165475 -0.853770
N 4.835374 0.064591 -1.167160
C 2.548516 -0.079542 -0.272358
C -0.164538 -0.139037 0.649629
C 4.047078 -0.016049 0.074861
C -0.734061 1.116586 0.320237
C -0.930828 -1.315557 0.482263
C -2.047068 1.199215 -0.184500
C -2.251836 -1.244397 -0.014600
C -2.804081 0.015475 -0.350724
H 2.316269 -0.956419 -0.901548
H 2.233953 0.837697 -0.794204
H 4.238204 0.897042 0.668032
H 4.309674 -0.884140 0.724835
H -0.149258 2.030320 0.469367
H -0.494721 -2.285014 0.743281
H -2.499605 2.160746 -0.443491
H -2.840748 -2.162700 -0.138484
H 4.884676 -0.800747 -1.709853
H 5.735211 0.542039 -1.090330
H -4.561332 -0.710979 -0.926204


