%chk=000081385.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081385

0 1
 S    2.745800     -0.3218000     -0.1007000    
 O    2.753700      -1.657500     -0.6807000    
 O    3.583400      0.7214000     -0.6755000    
 O   -2.058800      -2.370300     -1.7100001E-02
 O   -3.519700     -0.7325000      2.9500000E-02
 N   -2.337200      -1.148100      3.0000001E-04
 N    3.089600     -0.4436000       1.568600    
 C    1.096700      0.2509000     -5.9599999E-02
 C   -1.537000       1.168800      4.6000001E-03
 C   -1.276100     -0.2014000     -1.3200000E-02
 C   4.0700000E-02 -0.6603000     -4.5299999E-02
 C   0.8359000       1.621000     -4.1600000E-02
 C  -0.4810000       2.079900     -9.6000005E-03
 C   -2.935900       1.693400      4.0300000E-02
 H   0.2622000      -1.724500     -5.1899999E-02
 H    1.642900       2.348300     -4.5600001E-02
 H  -0.6643000       3.151000      5.5999998E-03
 H   -3.458100       1.408300      0.9595000    
 H   -2.929000       2.791400      5.0500002E-02
 H   -3.498100       1.425700     -0.8605000    
 H    3.175000      -1.385200       1.970400    
 H    3.740100      0.2413000       1.972600    


%chk=000081385-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081385

0 1
S 2.815587 -0.335534 -0.069864
O 2.791195 -1.838220 -0.692004
O 3.725687 0.879658 -0.657352
O -2.020526 -2.442907 0.210291
O -3.607286 -0.869884 -0.215166
N -2.384615 -1.223479 -0.002819
N 3.245603 -0.464814 1.710538
C 1.034615 0.281285 -0.020563
C -1.634441 1.219354 -0.002344
C -1.323537 -0.174564 -0.007880
C 0.005590 -0.659153 -0.014975
C 0.809341 1.666962 -0.024073
C -0.526729 2.112486 -0.012350
C -3.030592 1.805332 0.016568
H 0.198622 -1.735837 -0.036332
H 1.650670 2.366487 -0.056125
H -0.728454 3.188407 -0.011593
H -3.637050 1.398775 0.843882
H -2.978006 2.902213 0.116183
H -3.583532 1.555284 -0.905130
H 3.344534 -1.462944 1.959027
H 4.104124 0.087291 1.872682


