%chk=000097578.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097578

0 1
 S    3.056500      0.8459000     -0.5172000    
 N   0.4718000       1.418600     -0.1972000    
 N   -2.464400     -0.5305000      0.1820000    
 N    1.122900     -0.9781000     -0.2639000    
 N   -1.910700       1.711300      9.8999999E-02
 N   -2.840500      0.7555000      0.2212000    
 N  -0.4489000      -2.791700     -5.6200001E-02
 C   -1.134700     -0.4329000      1.5100000E-02
 C  -0.8033000      0.9758000     -3.4899998E-02
 C  -0.1509000      -1.421000     -0.1019000    
 C    1.341600      0.3738000     -0.2997000    
 C    3.760700      7.3200002E-02  0.9537000    
 H   -3.816500       1.001000      0.3418000    
 H   0.3006000      -3.464200     -0.1454000    
 H   -1.403300      -3.102000      6.5200001E-02
 H    4.822700      0.3247000       1.019200    
 H    3.667200      -1.015000      0.9038000    
 H    3.261900      0.4382000       1.855900    


%chk=000097578-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097578

0 1
S 2.939246 1.320412 0.363332
N 0.296635 1.577972 0.048084
N -2.592630 -0.605802 -0.074416
N 1.116147 -0.731589 0.340221
N -2.158811 1.713097 -0.230007
N -3.059488 0.673901 -0.237922
N -0.297143 -2.618280 0.350133
C -1.240712 -0.374795 0.052686
C -0.960234 1.036904 -0.040561
C -0.128032 -1.263714 0.251660
C 1.256998 0.642349 0.235594
C 3.954028 -0.243327 0.608652
H -4.054290 0.855998 -0.361987
H 0.520582 -3.209113 0.489487
H -1.226852 -3.026584 0.282666
H 4.996320 0.102634 0.695482
H 3.835083 -0.908613 -0.257430
H 3.635852 -0.758851 1.524825


