%chk=000067678.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067678

0 1
 S  -0.4126000     -0.2308000      0.9457000    
 S   0.4167000     -0.2255000     -0.9335000    
 O   -3.240900      -1.594200      -1.003600    
 O    3.247100      -1.593500       1.001500    
 O   -4.046300     -0.8876000      0.9959000    
 O    4.042100     -0.8862000      -1.001900    
 N   -3.766600       1.685300     -0.4069000    
 N    3.765600       1.686600      0.4017000    
 C   -2.727500      0.6575000     -0.3169000    
 C    2.727600      0.6574000      0.3168000    
 C   -1.715000       1.030100      0.7677000    
 C    1.709500       1.028500     -0.7631000    
 C   -3.415800     -0.6642000     -3.1099999E-02
 C    3.416200     -0.6634000      2.7899999E-02
 H   -2.252500      0.6060000      -1.301600    
 H    2.263600      0.6043000       1.306300    
 H   -1.245500       1.998100      0.5588000    
 H   -2.208700       1.116500       1.742700    
 H    1.242800       1.997400     -0.5517000    
 H    2.199000       1.116800      -1.740100    
 H   -4.381300       1.482700      -1.194600    
 H   -3.337900       2.588400     -0.6069000    
 H    3.335700       2.584900      0.6209000    
 H    4.207900       1.806700     -0.5093000    
 H   -3.683100      -2.441700     -0.7833000    
 H    3.689300      -2.440400      0.7792000    


%chk=000067678-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000067678

0 1
S -0.483393 -0.449367 0.794421
S 0.677666 -0.257406 -1.154835
O -4.927713 -0.967608 -0.536221
O 4.033061 -1.416917 0.742605
O -3.715289 -1.050930 1.442442
O 4.349160 -0.416552 -1.333447
N -3.736171 1.522179 -0.906053
N 3.735521 1.868285 0.742611
C -2.927369 0.372241 -0.448625
C 2.912602 0.706538 0.355646
C -1.812577 0.864313 0.490517
C 1.873864 1.138455 -0.691093
C -3.848933 -0.605192 0.286845
C 3.802151 -0.416039 -0.206384
H -2.457574 -0.203947 -1.283271
H 2.390854 0.333342 1.252472
H -1.316752 1.752982 0.068179
H -2.213407 1.111878 1.487394
H 1.300989 1.996936 -0.309274
H 2.358535 1.403672 -1.649161
H -4.636044 1.253556 -1.316357
H -3.212426 2.177720 -1.493695
H 4.183786 1.796049 1.659346
H 4.365781 2.205941 0.008461
H -5.520228 -1.600636 -0.047461
H 4.653307 -2.099792 0.365537


