%chk=000148025.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148025

0 1
 S    3.607900     -0.8384000      -1.423700    
 O    1.460200     -0.1535000     -0.1695000    
 O  -0.3534000       2.138500      -1.334700    
 O   -2.623300      -1.495100       1.145600    
 N   -1.427600     -0.2380000     -0.4076000    
 N  -0.5860000       3.013800      0.7760000    
 C  -0.7287000      0.6135000      0.5196000    
 C   0.6017000      7.3000002E-03  0.9539000    
 C  -0.5482000       1.977200     -0.1324000    
 C   -2.319700      -1.224500     -1.3400000E-02
 C   -2.927900      -1.949800      -1.183700    
 C    2.689700     -0.7024000     -3.9799999E-02
 C    3.155400      -1.148700       1.309700    
 H   -1.362600      0.7290000       1.407700    
 H    1.083600      0.6719000       1.679900    
 H   0.4234000     -0.9686000       1.419400    
 H   -1.241100     -0.1183000      -1.399600    
 H   -3.475000      -2.827800     -0.8295000    
 H   -3.617900      -1.282900      -1.707800    
 H   -2.144800      -2.279300      -1.872600    
 H  -0.7282000       2.864100       1.769700    
 H  -0.4679000       3.975200      0.4736000    
 H    4.171300      -1.555000       1.269200    
 H    3.164800     -0.3031000       2.002900    
 H    2.498700      -1.935200       1.691600    


%chk=000148025-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148025

0 1
S 3.600809 -0.395883 -1.048431
O 1.644738 0.580591 0.423738
O -1.071114 2.251931 -1.441264
O -1.537375 -1.738052 1.309427
N -1.230956 -0.124870 -0.327538
N -0.244402 3.339984 0.430159
C -0.800553 0.917081 0.604025
C 0.499019 0.553765 1.361884
C -0.702450 2.225981 -0.229565
C -1.620039 -1.380683 0.086477
C -2.138663 -2.310141 -1.002408
C 2.393186 -0.554832 0.114267
C 2.097854 -1.836907 0.866088
H -1.574582 1.057446 1.390547
H 0.724940 1.306391 2.139637
H 0.356884 -0.426804 1.840505
H -1.337424 0.198471 -1.298772
H -1.515109 -3.220365 -1.034564
H -3.163534 -2.628070 -0.744177
H -2.147012 -1.847370 -2.003318
H 0.132636 3.303255 1.374957
H -0.152099 4.206312 -0.100414
H 2.759566 -2.628153 0.489426
H 2.282925 -1.715066 1.951917
H 1.047156 -2.164113 0.751897


