%chk=000154710.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154710

0 1
 S   -1.161400       2.251000      0.6809000    
 O   -2.273300       2.318400       1.617400    
 O  -0.8099000       3.433900     -8.9500003E-02
 O    4.331700      -2.228200     -0.4307000    
 O    2.750600      -2.636500       1.036400    
 N   0.2223000       1.672000       1.524300    
 N   -2.199400     -0.4654000       1.336700    
 N    3.345100      -1.859100      0.2511000    
 C   -1.498300      0.9427000     -0.4400000    
 C   -1.983900     -0.2780000      2.0900000E-02
 C   -2.236600      -1.292000     -0.9267000    
 C   -1.263300       1.171900      -1.797900    
 C    1.351300       1.224900      0.7538000    
 C   -2.000300      -1.061700      -2.292600    
 C   -1.514500      0.1686000      -2.725700    
 C   -2.725500      -2.520900     -0.4633000    
 C    1.792500     -8.6999997E-02  0.8782000    
 C    1.988800       2.110200     -0.1072000    
 C    2.887400     -0.5203000      0.1304000    
 C   -2.948600      -2.717000      0.8920000    
 C   -2.671800      -1.666200       1.742700    
 C    3.083900       1.676800     -0.8549000    
 C    3.533100      0.3617000     -0.7362000    
 H   3.5300002E-02   1.122200       2.373200    
 H  -0.8811000       2.120600      -2.162300    
 H   -2.193300      -1.840400      -3.027100    
 H   -1.331900      0.3421000      -3.781800    
 H   -2.935100      -3.332400      -1.156400    
 H    1.270400     -0.7549000       1.559300    
 H    1.678300       3.146000     -0.1965000    
 H   -3.326100      -3.660800       1.267500    
 H   -2.826200      -1.761100       2.812500    
 H    3.590500       2.365600      -1.524600    
 H    4.389800      5.9799999E-02  -1.333200    


%chk=000154710-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000154710

0 1
S -1.041358 2.323760 0.288104
O -2.217474 2.857999 1.255600
O -0.277257 3.334779 -0.731509
O 4.852843 -2.139375 -0.158242
O 2.875103 -2.778420 0.778503
N 0.271758 1.521462 1.451745
N -1.832778 -0.545428 1.172078
N 3.679855 -1.879736 0.313841
C -1.699742 0.894948 -0.796607
C -2.077157 -0.335260 -0.179093
C -2.689117 -1.339659 -1.026719
C -1.848073 1.144287 -2.154616
C 1.508420 1.175091 0.854370
C -2.857765 -1.075453 -2.424611
C -2.433311 0.132775 -2.980983
C -3.093476 -2.565462 -0.404177
C 1.941383 -0.177283 0.820657
C 2.361245 2.198989 0.343697
C 3.225773 -0.465901 0.319795
C -2.878756 -2.749303 0.962401
C -2.231746 -1.714759 1.709808
C 3.625391 1.867498 -0.183747
C 4.083230 0.531563 -0.193796
H -0.285086 0.717663 1.823939
H -1.517491 2.101403 -2.572124
H -3.321099 -1.841972 -3.056444
H -2.554994 0.322624 -4.051702
H -3.563879 -3.347618 -1.010488
H 1.310808 -0.992334 1.188821
H 2.020732 3.236881 0.377397
H -3.177219 -3.671699 1.467914
H -2.026315 -1.851971 2.777051
H 4.269627 2.661678 -0.573702
H 5.068429 0.254732 -0.576465


