%chk=000122084.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122084

0 1
 S   -1.461800     -0.9027000     -0.5240000    
 O   0.4873000      -3.178500      4.4500001E-02
 O    3.222800      -2.963900      0.2540000    
 O   -3.650800       2.109400     -0.7054000    
 O   -5.005200      0.3082000     -0.9538000    
 N   -4.118800     -0.8534000       1.387400    
 N    3.771100       3.889900      0.5519000    
 C    2.331900      0.5139000     -0.4289000    
 C    3.002500       1.835300     -0.5971000    
 C   0.3181000     -0.8198000     -0.3778000    
 C   0.9445000      0.4163000     -0.5360000    
 C   -1.979300      0.2256000      0.8121000    
 C   -3.497500      0.3697000      0.9443000    
 C    3.092700     -0.6247000     -0.1632000    
 C    3.137400       2.588400      0.7339000    
 C    1.078900      -1.958400     -0.1125000    
 C    2.466200      -1.860800     -5.1000002E-03
 C   -4.140200      0.9053000     -0.3244000    
 H    3.993300       1.691600      -1.048500    
 H    2.438900       2.444000      -1.317000    
 H   0.3653000       1.310800     -0.7543000    
 H   -1.555500     -0.1377000       1.756000    
 H   -1.543300       1.212400      0.6241000    
 H   -3.697600       1.119800       1.720100    
 H    4.174300     -0.5547000     -7.6300003E-02
 H    3.730500       2.002000       1.445000    
 H    2.151700       2.737400       1.189500    
 H   -3.976300      -1.590400      0.6981000    
 H   -5.126400     -0.7273000       1.473100    
 H    3.228000       4.443200     -0.1101000    
 H    4.687900       3.764900      0.1239000    
 H  -0.4737000      -3.067200     -5.8400001E-02
 H    2.628600      -3.730200      0.3336000    
 H   -4.073100       2.432900      -1.529600    


%chk=000122084-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122084

0 1
S -1.578028 0.818616 -0.821928
O -0.531066 -1.918185 0.709565
O 1.982968 -2.557161 1.151469
O -5.409162 1.100264 0.786304
O -5.283011 -0.424077 -0.968805
N -3.043331 -1.693339 0.177834
N 5.228971 3.505370 -0.011075
C 2.549975 0.719241 -0.543934
C 3.692604 1.650862 -0.913465
C 0.129991 0.259613 -0.382847
C 1.205845 1.097601 -0.775530
C -2.461312 0.648377 0.855486
C -3.559826 -0.452968 0.815010
C 2.810170 -0.513644 0.112361
C 4.120406 2.578037 0.275486
C 0.385759 -0.977868 0.255948
C 1.746979 -1.337910 0.509664
C -4.824399 0.040143 0.095895
H 4.580061 1.067956 -1.231160
H 3.406135 2.295266 -1.768173
H 0.983223 2.053897 -1.261489
H -1.691113 0.386347 1.596323
H -2.903990 1.622485 1.110895
H -3.841117 -0.672492 1.862155
H 3.835283 -0.841937 0.314271
H 4.406484 1.946257 1.137353
H 3.243095 3.169112 0.599912
H -3.104085 -1.606554 -0.850202
H -3.567133 -2.527393 0.477733
H 5.015419 4.207945 -0.726332
H 6.127521 3.045604 -0.189914
H -1.571959 -1.799864 0.455638
H 1.085192 -2.964492 1.314925
H -6.214149 1.426192 0.299727


