%chk=000153570.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153570

0 1
 S  -0.4809000      7.9999998E-04  -1.589800    
 O    1.545800       3.507000     -4.3000001E-03
 O    0.000000       2.525400      -1.215100    
 O    1.544400      -3.507700     -5.5000000E-03
 O  -2.0999999E-03  -2.525300      -1.214700    
 N    3.138000     -8.9999998E-04   1.241800    
 N   0.9861000       2.474400     -0.4427000    
 N   0.9848000      -2.474700     -0.4430000    
 N   -1.478100      1.0000000E-03  0.8878000    
 N   -3.067500      7.9999998E-04 -0.9235000    
 C   0.9368000     -1.9999999E-04 -0.4809000    
 C    1.487100       1.202200     -5.0900001E-02
 C    1.485800      -1.202900     -5.0500002E-02
 C    2.577300       1.148100      0.8025000    
 C    2.576300      -1.149400      0.8026000    
 C   -1.821700      1.3000000E-03 -0.4137000    
 C   -2.516300      1.9999999E-04   1.749600    
 C   -4.056900      1.9999999E-04 -6.0999999E-03
 C   -3.839100     -3.0000001E-04   1.356500    
 H    3.069300       2.036200       1.187600    
 H    3.067800      -2.037900       1.187600    
 H   -2.246200       0.000000       2.800100    
 H   -5.063600     -1.9999999E-04 -0.4102000    
 H   -4.652100     -8.9999998E-04   2.069900    


%chk=000153570-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153570

0 1
S -0.488151 0.001528 -1.639258
O 1.894974 3.447617 -0.623425
O -0.253302 2.732132 -0.300162
O 1.888209 -3.450615 -0.609276
O -0.259368 -2.727066 -0.300048
N 3.287723 0.000096 1.196285
N 1.016443 2.542510 -0.346892
N 1.011191 -2.541567 -0.340686
N -1.568470 0.001612 0.889241
N -3.100388 -0.001304 -1.005912
C 0.905620 0.000504 -0.434579
C 1.539843 1.193637 -0.009091
C 1.537127 -1.192960 -0.005916
C 2.709030 1.160883 0.788722
C 2.706166 -1.160484 0.792193
C -1.872127 0.001046 -0.434727
C -2.639512 0.000252 1.736006
C -4.155577 -0.002683 -0.138935
C -3.971454 -0.001879 1.263073
H 3.186798 2.096952 1.093488
H 3.181445 -2.096809 1.099976
H -2.408805 0.000986 2.806297
H -5.152098 -0.004273 -0.591813
H -4.820317 -0.002915 1.950541


