%chk=000038348.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038348

0 1
 S   -2.170500      1.2000001E-03  -1.243500    
 O  -0.1695000      -2.322000     -0.5817000    
 O  -0.1686000       2.323000     -0.5796000    
 N  -0.5755000      6.9999998E-04 -0.7158000    
 C    1.464200     -0.6944000     -4.1099999E-02
 C    1.464500      0.6942000     -4.0700000E-02
 C   0.1434000      -1.150500     -0.4782000    
 C   0.1440000       1.151200     -0.4774000    
 C   -2.991900      8.9999998E-04  0.3645000    
 C   -4.506600      1.3000000E-03  0.1907000    
 C    2.575700      -1.424400      0.3268000    
 C    2.576100       1.423600      0.3280000    
 C    3.713600     -0.7057000      0.7041000    
 C    3.713800      0.7041000      0.7051000    
 C   -5.212700     -3.1000001E-03   1.538600    
 H   -2.677800      0.8863000      0.9278000    
 H   -2.678200     -0.8854000      0.9269000    
 H   -4.826700      0.8873000     -0.3711000    
 H   -4.826700     -0.8813000     -0.3764000    
 H    2.576200      -2.508000      0.3268000    
 H    2.577000       2.507200      0.3289000    
 H    4.612600      -1.239400       1.001900    
 H    4.612900       1.237200       1.003400    
 H   -4.945900      0.8825000       2.124300    
 H   -6.298100     -2.6000000E-03   1.397700    
 H   -4.945900     -0.8925000       2.118500    


%chk=000038348-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038348

0 1
S -2.232621 0.000697 -1.223087
O -0.192241 -2.368493 -0.513398
O -0.193218 2.368761 -0.507118
N -0.541279 0.000259 -0.651734
C 1.589888 -0.707842 -0.025908
C 1.589603 0.707555 -0.024041
C 0.227098 -1.194500 -0.415225
C 0.226602 1.194679 -0.412026
C -3.134904 -0.000516 0.456597
C -4.651057 -0.000188 0.187915
C 2.740472 -1.440583 0.304321
C 2.739893 1.439891 0.308104
C 3.909541 -0.709866 0.639697
C 3.909259 0.708766 0.641547
C -5.452164 -0.000780 1.510486
H -2.819344 0.904457 1.000966
H -2.819471 -0.906333 0.999637
H -4.923030 0.891219 -0.409965
H -4.923259 -0.890894 -0.410902
H 2.727097 -2.534883 0.298883
H 2.726070 2.534196 0.305554
H 4.827763 -1.246650 0.901018
H 4.827266 1.245231 0.904280
H -5.220081 0.893244 2.118080
H -6.538032 -0.000441 1.307746
H -5.220452 -0.895585 2.117070


