%chk=000141285.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141285

0 1
 S    1.270700      -2.446200      0.9553000    
 P    1.489700     -0.7189000      8.1299998E-02
 O   0.2660000     -0.3775000     -0.9400000    
 N    1.616600      0.6574000       1.040700    
 N    2.871100     -0.4553000     -0.8240000    
 C    2.924800       1.291900      0.7920000    
 C    3.307800      0.9347000     -0.6476000    
 C   -1.003200     -9.7999997E-02 -0.5113000    
 C   -1.364800       1.216900     -0.2364000    
 C   -1.921500      -1.131000     -0.3539000    
 C   -2.658400       1.501800      0.2005000    
 C   -3.215200     -0.8461000      8.2999997E-02
 C   -3.583700      0.4703000      0.3603000    
 H    3.661300      0.8763000       1.489200    
 H    2.867800       2.373900      0.9394000    
 H    2.769400       1.577500      -1.352900    
 H    4.382800       1.036900     -0.8182000    
 H    1.457200      0.5656000       2.042700    
 H    2.868000     -0.7077000      -1.810600    
 H  -0.6517000       2.026200     -0.3653000    
 H   -1.648500      -2.157500     -0.5802000    
 H   -2.945800       2.527000      0.4147000    
 H   -3.936600      -1.648900      0.2043000    
 H   -4.591400      0.6922000      0.6994000    


%chk=000141285-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000141285

0 1
S 0.971382 -2.344987 1.236888
P 1.499082 -0.594193 0.274555
O 0.198174 0.040228 -0.794605
N 2.104227 0.742078 1.203216
N 2.835789 -0.489889 -0.816989
C 3.395050 1.283008 0.717427
C 3.499627 0.832478 -0.768665
C -1.162050 0.098360 -0.400020
C -1.695747 1.345620 0.000614
C -1.978616 -1.053780 -0.475943
C -3.069386 1.440161 0.317334
C -3.349585 -0.946632 -0.151369
C -3.898855 0.295655 0.244455
H 4.242048 0.870320 1.302398
H 3.410742 2.385151 0.784939
H 2.997720 1.570240 -1.428190
H 4.556601 0.737244 -1.070060
H 1.838234 0.841337 2.182158
H 2.851982 -1.042001 -1.673109
H -1.035796 2.218002 0.046712
H -1.536739 -2.008266 -0.776184
H -3.490621 2.405406 0.620310
H -3.987775 -1.835595 -0.206573
H -4.963089 0.371556 0.493102


