%chk=000037558.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037558

0 1
 O  -0.5940000       1.840200     -0.3352000    
 N   -1.166000     -0.3933000      0.1003000    
 N    5.219700     -0.6813000      8.6000003E-02
 N   -3.329500      -1.424900      0.2893000    
 N   -3.221800      0.7943000     -0.1483000    
 N   -4.526200     -0.8343000      0.1630000    
 N   -4.510500      0.4805000     -9.6199997E-02
 C    1.142600      0.3184000     -5.3199999E-02
 C    2.083700       1.278300      0.3189000    
 C    1.555400     -0.9736000     -0.3790000    
 C    3.850600     -0.3457000      3.9200000E-02
 C  -0.2689000      0.6647000     -0.1021000    
 C    3.437700      0.9463000      0.3650000    
 C    2.909400      -1.305700     -0.3329000    
 C   -2.582200     -0.3639000      8.5400000E-02
 H    1.782900       2.289300      0.5815000    
 H   0.8644000      -1.743200     -0.7098000    
 H    4.161400       1.702700      0.6575000    
 H    3.220000      -2.313500     -0.5968000    
 H  -0.8089000      -1.317600      0.3234000    
 H    5.519600      -1.617800     -0.1504000    
 H    5.902500      1.4300000E-02  0.3555000    
 H   -5.393300      -1.352100      0.2586000    


%chk=000037558-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037558

0 1
O -0.653731 1.905380 0.045733
N -1.214721 -0.375297 0.106550
N 5.293973 -0.670614 0.016860
N -3.384834 -1.315390 0.486540
N -3.338049 0.763474 -0.536083
N -4.632191 -0.841786 0.167126
N -4.644384 0.404030 -0.437926
C 1.147500 0.278104 0.028546
C 2.124190 1.257892 0.357897
C 1.597862 -1.022946 -0.328595
C 3.939379 -0.360225 0.016407
C -0.285172 0.699755 0.049684
C 3.491003 0.952380 0.359576
C 2.965432 -1.342249 -0.337008
C -2.597638 -0.284130 0.028732
H 1.774906 2.265384 0.607202
H 0.888186 -1.794195 -0.653237
H 4.224777 1.723403 0.623452
H 3.290833 -2.347482 -0.630349
H -0.862474 -1.301405 0.356177
H 5.618258 -1.600823 -0.232134
H 5.989237 0.031785 0.253114
H -5.483740 -1.362944 0.371435


