%chk=000035406.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035406

0 1
 S    1.758800     -0.5051000      0.8220000    
 S    4.363300      -1.913700      0.9567000    
 O  -0.4713000       1.201200     -0.9928000    
 N    4.087900      0.6903000      8.2500003E-02
 C  -0.2695000      -1.204500     -0.9256000    
 C    1.249300      -1.096700     -0.8097000    
 C  -0.9951000      0.1209000     -0.7305000    
 C   -2.396800      9.9699996E-02 -0.2252000    
 C   -3.192800     -0.9828000     -0.5276000    
 C   -2.845300       1.163600      0.5255000    
 C    3.519400     -0.4989000      0.5803000    
 C   -4.505000      -1.002400     -5.4800000E-02
 C   -4.157400       1.144000      0.9984000    
 C   -4.987200      6.1000001E-02  0.7082000    
 C    5.524400      0.8276000     -0.1696000    
 C    3.317300       1.895700     -0.2378000    
 H  -0.6287000      -1.934700     -0.1908000    
 H  -0.5240000      -1.575800      -1.925100    
 H    1.691700      -2.081100     -0.9938000    
 H    1.634100     -0.4107000      -1.571900    
 H   -2.847500      -1.814600      -1.132900    
 H   -2.208600       2.010300      0.7633000    
 H   -5.152600      -1.843700     -0.2838000    
 H   -4.532800       1.971400       1.593500    
 H    6.085600     -9.8499998E-02 -4.8599999E-02
 H    5.926500       1.571700      0.5251000    
 H    5.664400       1.179800      -1.196600    
 H    3.938300       2.782700     -7.5999998E-02
 H    2.425700       2.001200      0.3817000    
 H    3.027700       1.846000      -1.291400    
 H   -6.009100      4.6000000E-02   1.075900    


%chk=000035406-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035406

0 1
S 2.123718 0.990837 -1.375721
S 3.042035 -1.801544 -0.259326
O -1.141442 1.385331 -2.102979
N 3.995177 0.651013 0.527920
C -0.124272 -0.752393 -1.524080
C 1.108319 -0.296530 -2.308483
C -1.222845 0.311685 -1.435257
C -2.415819 0.040462 -0.561279
C -2.555739 -1.158970 0.188848
C -3.442048 1.022576 -0.493572
C 3.153579 -0.089257 -0.267443
C -3.699587 -1.370383 0.988117
C -4.581832 0.812128 0.306423
C -4.713922 -0.386521 1.049761
C 4.900232 0.011747 1.505460
C 4.057095 2.128808 0.450901
H 0.185985 -1.094785 -0.519033
H -0.557274 -1.646868 -2.022051
H 1.787100 -1.143378 -2.501422
H 0.834911 0.220696 -3.242002
H -1.777890 -1.928682 0.154975
H -3.315605 1.938684 -1.080296
H -3.800362 -2.297235 1.563251
H -5.366729 1.574905 0.353679
H 4.726611 -1.074561 1.496146
H 4.701458 0.408899 2.518182
H 5.954466 0.213518 1.237951
H 4.817556 2.486798 1.161753
H 3.082984 2.582325 0.711261
H 4.335197 2.462251 -0.565629
H -5.600357 -0.551658 1.672545


