%chk=000001346.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001346

0 1
 O   0.8314000       1.986300     -0.1457000    
 N  -0.8115000     -0.3073000     -3.2200001E-02
 N   -3.662000     -0.2752000     -0.1840000    
 C   -1.481200      0.3451000      -1.165500    
 C   -1.595800      -1.331500      0.6663000    
 C   -2.878500      0.8152000     -0.7630000    
 C   -2.989900     -0.8023000       1.002400    
 C   0.5847000     -0.3997000     -5.6899998E-02
 C    1.401600      0.7487000     -0.1136000    
 C    1.218300      -1.658800     -2.5100000E-02
 C    2.792300      0.6417000     -0.1372000    
 C    2.608900      -1.765600     -4.8900001E-02
 C    3.395900     -0.6154000     -0.1050000    
 C   0.5858000       2.618700       1.108300    
 H   -1.555700     -0.3743000      -1.991900    
 H  -0.9277000       1.205700      -1.552500    
 H   -1.106000      -1.622100       1.603900    
 H   -1.684300      -2.226400      3.7099998E-02
 H   -2.806800       1.645300     -4.8999999E-02
 H   -3.398700       1.196900      -1.648300    
 H   -3.591600      -1.614900       1.424000    
 H   -2.922300     -2.1400001E-02   1.770400    
 H   -4.582700      7.5199999E-02  7.8800000E-02
 H   0.6400000      -2.578800      5.2000000E-03
 H    3.411900       1.533400     -0.1819000    
 H    3.079300      -2.744200     -2.7000001E-02
 H    4.478500     -0.6986000     -0.1245000    
 H    1.525800       2.785600       1.643800    
 H  -9.3199998E-02   2.016300       1.720000    
 H   0.1158000       3.587200      0.9168000    


%chk=000001346-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001346

0 1
O 0.974530 2.070454 -0.278396
N -0.787154 -0.226775 0.083954
N -3.641444 -0.220798 -0.163216
C -1.455444 0.478737 -1.049620
C -1.591733 -1.359066 0.596170
C -2.862758 0.943282 -0.637728
C -2.997208 -0.869825 0.995924
C 0.625718 -0.387091 0.012819
C 1.487896 0.747015 -0.170309
C 1.252654 -1.659897 0.149456
C 2.882637 0.591527 -0.279866
C 2.654585 -1.806619 0.070876
C 3.479588 -0.684723 -0.164030
C 0.403918 2.597866 0.980589
H -1.547380 -0.211346 -1.918573
H -0.837724 1.342029 -1.343056
H -1.091039 -1.783690 1.484736
H -1.699537 -2.164372 -0.168099
H -2.758050 1.738957 0.142662
H -3.368494 1.386500 -1.514802
H -3.604685 -1.737606 1.312313
H -2.888378 -0.181275 1.871709
H -4.632667 -0.004098 -0.002291
H 0.634627 -2.552464 0.286476
H 3.484793 1.493033 -0.435413
H 3.096919 -2.804032 0.173961
H 4.566097 -0.795173 -0.243241
H 1.190077 2.658167 1.757661
H -0.425823 1.958017 1.334750
H 0.037780 3.608066 0.739381


