%chk=000044656.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044656

0 1
 N    3.108000      0.3023000     -5.4800000E-02
 N    4.032200     -0.7486000      0.2089000    
 C   0.6909000      0.8612000     -0.1588000    
 C    1.754100     -0.2608000      1.0900000E-02
 C  -0.7354000      0.3363000     -5.6800000E-02
 C   0.8834000       2.005700      0.8506000    
 C    1.632600      -1.347200      -1.063800    
 C   -1.005800     -0.6904000      0.8238000    
 C   -1.711900      0.9037000     -0.8487000    
 C   -2.311900      -1.171100      0.9169000    
 C   -3.018100      0.4231000     -0.7555000    
 C   -3.318100     -0.6143000      0.1274000    
 H   0.8215000       1.286200      -1.165000    
 H    1.647900     -0.7243000      0.9988000    
 H    1.811300       2.556700      0.6696000    
 H   6.7800000E-02   2.735100      0.7799000    
 H   0.8996000       1.630000       1.879800    
 H    2.307800      -2.191900     -0.8881000    
 H   0.6273000      -1.776400      -1.104400    
 H    1.850000     -0.9436000      -2.060100    
 H    3.229900       1.017700      0.6594000    
 H  -0.2672000      -1.131600       1.481200    
 H   -1.487800       1.713000      -1.537000    
 H   -2.547800      -1.973800       1.609600    
 H   -3.801800      0.8573000      -1.369500    
 H   -4.335400     -0.9873000      0.2014000    
 H    4.979400     -0.3926000      8.6400002E-02
 H    3.964200      -1.026600       1.187600    


%chk=000044656-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000044656

0 1
N 3.129282 0.297917 -0.042412
N 4.173105 -0.665343 0.081364
C 0.717440 0.886951 0.013505
C 1.755513 -0.283937 0.009854
C -0.715478 0.349904 0.015329
C 0.918824 1.873937 1.200251
C 1.562254 -1.233603 -1.185491
C -1.210592 -0.417252 1.103954
C -1.590036 0.617093 -1.067766
C -2.536848 -0.902118 1.107363
C -2.919752 0.135826 -1.069249
C -3.398793 -0.627612 0.019384
H 0.877959 1.447865 -0.929104
H 1.610336 -0.870717 0.953434
H 1.856645 2.453284 1.110543
H 0.090515 2.603860 1.233251
H 0.932585 1.340275 2.169556
H 2.393807 -1.957940 -1.204252
H 0.605747 -1.779027 -1.111941
H 1.575553 -0.662593 -2.132393
H 3.234142 1.089296 0.610630
H -0.556264 -0.636836 1.956514
H -1.224369 1.206328 -1.917899
H -2.899246 -1.493797 1.956136
H -3.578308 0.355037 -1.917682
H -4.428365 -1.003032 0.021329
H 4.935164 -0.527444 -0.582359
H 4.455883 -0.948523 1.027851


