%chk=000145291.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145291

0 1
 S   -1.651300      -1.540900      0.2706000    
 O    4.689100      0.2263000     -0.2821000    
 O   -4.049900      -2.242100     -0.6293000    
 O   -3.568700       2.219900      0.6285000    
 N   -1.597800       1.161000      0.1310000    
 C   0.5526000      9.8200001E-02  3.6600001E-02
 C    1.165500       1.125800     -0.6805000    
 C    1.329800     -0.8862000      0.6469000    
 C  -0.9282000      5.1800001E-02  0.1504000    
 C    3.332800      0.1843000     -0.1774000    
 C    2.555600       1.168700     -0.7877000    
 C    2.719900     -0.8430000      0.5400000    
 C   -3.257100      -1.187200     -0.2300000    
 C   -2.965400       1.222300      0.2412000    
 C   -3.749800      5.2700002E-02 -0.2244000    
 C    5.423000     -0.8116000      0.3661000    
 H   0.5801000       1.899400      -1.170300    
 H   0.8998000      -1.687100       1.240800    
 H    3.027500       1.970500      -1.349100    
 H    3.263800      -1.634900       1.043800    
 H   -4.777500      0.2438000     -0.5177000    
 H    5.193100      -1.793900     -6.0300000E-02
 H    5.281100     -0.7868000       1.451900    
 H    6.484900     -0.6223000      0.1783000    
 H   -3.494400      -3.036500     -0.5454000    


%chk=000145291-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000145291

0 1
S -1.689277 -1.679575 0.250027
O 4.776307 0.388438 0.047962
O -4.354712 -2.233243 0.257621
O -3.541112 2.362476 -0.746583
N -1.618902 1.095968 -0.384268
C 0.560568 0.058969 -0.057503
C 1.235949 1.294697 -0.303843
C 1.336865 -1.093009 0.229739
C -0.911392 0.052323 -0.116319
C 3.395639 0.204363 0.029235
C 2.631651 1.367790 -0.261366
C 2.742609 -1.032078 0.275295
C -3.436117 -1.209823 0.065248
C -3.047531 1.231554 -0.472524
C -3.881449 0.047073 -0.240819
C 5.626063 -0.771788 0.346120
H 0.631465 2.179008 -0.525339
H 0.851928 -2.056664 0.421687
H 3.159487 2.307484 -0.447379
H 3.312073 -1.938166 0.499408
H -4.961082 0.203473 -0.323294
H 5.498437 -1.565651 -0.414145
H 5.410012 -1.175935 1.353320
H 6.654838 -0.386289 0.312451
H -3.923817 -3.099197 0.477170


