%chk=000035128.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035128

0 1
 S    1.530700      -1.025100      0.6779000    
 N  -0.2835000      0.8927000      0.2873000    
 N   -1.053000      -1.372800      0.1070000    
 N   -2.585300      0.4444000     -0.2214000    
 N   -1.803800       2.648100     -3.8199998E-02
 N   -3.307900      -1.780600     -0.3904000    
 C  -0.1204000     -0.4356000      0.3169000    
 C    2.549100      0.3124000     -8.9999998E-04
 C   -1.545000       1.261000      1.1400000E-02
 C   -2.264800     -0.8580000     -0.1570000    
 C    3.999000      1.0200000E-02  0.2021000    
 C    4.885000     -9.6699998E-02 -0.7947000    
 H    2.312100      0.4417000      -1.062500    
 H    2.317800       1.249800      0.5157000    
 H    4.356500     -0.1012000       1.223200    
 H   -1.050600       3.300500      0.1306000    
 H   -2.739000       2.972300     -0.2424000    
 H   -4.237400      -1.439300     -0.5929000    
 H   -3.112900      -2.771500     -0.3518000    
 H    5.928100     -0.3040000     -0.5823000    
 H    4.589700      1.8700000E-02  -1.831700    


%chk=000035128-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035128

0 1
S 1.490394 -1.313824 -0.863871
N -0.199099 0.784042 -0.254850
N -1.131252 -1.454907 -0.324906
N -2.574781 0.448934 0.205163
N -1.612877 2.583484 0.257659
N -3.411863 -1.739067 0.120236
C -0.111764 -0.561518 -0.433756
C 2.624361 0.229578 -0.915048
C -1.462622 1.235780 0.064236
C -2.346327 -0.888795 -0.002009
C 3.655528 0.177887 0.175217
C 4.995326 0.115554 -0.039233
H 3.071828 0.253101 -1.920887
H 1.916058 1.068122 -0.786909
H 3.266377 0.202687 1.202762
H -0.804810 3.192465 0.160804
H -2.531022 2.949745 0.495505
H -4.325921 -1.361914 0.356251
H -3.265698 -2.734160 -0.029797
H 5.708534 0.101175 0.792095
H 5.414030 0.078632 -1.052761


